Screening compound: InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2

Screening compound: InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2
Screening compound: InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

3229-0180

Molecular Formula

C20H13Cl2NO3S2 (C20 H13 Cl2 NO3 S2)

Compound Name

4-{[(5E)-4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 2,4-dichlorobenzoate

IUPAC name

4-{[(5E)-4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-13-thiazolidin-5-ylidene]methyl}phenyl 24-dichlorobenzoate

SMILES

C=CCN(C(/C(/S1)=C\c(cc2)ccc2OC(c(ccc(Cl)c2)c2Cl)=O)=O)C1=S

InChI

InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2

InChI Key

WLFTZBZBBOKFSH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01100392

InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of InChI=1S/C20H13Cl2NO3S2/c1-2-9-23-18(24)17(28-20(23)27)10-12-3-6-14(7-4-12)26-19(25)15-8-5-13(21)11-16(15)22/h2-8,10-11H,1,9H2 available by request