Screening compound: InChI=1S/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3

Screening compound: InChI=1S/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3
Screening compound: InChI=1S/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3

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

V006-2800

Molecular Formula

C20H21N3OS (C20 H21 N3 OS)

Compound Name

3-(4-methoxyphenyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole

IUPAC name

3-(4-methoxyphenyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-124-triazole

SMILES

Cc1ccc(CSc2nnc(-c(cc3)ccc3OC)n2CC=C)cc1

InChI

InChI=1S/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3

InChI Key

VQEUGVJIKNLYTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05687200

InChI=1S/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with InChI=1S/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3 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/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3
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/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3
  • 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/C20H21N3OS/c1-4-13-23-19(17-9-11-18(24-3)12-10-17)21-22-20(23)25-14-16-7-5-15(2)6-8-16/h4-12H,1,13-14H2,2-3H3 available by request