Vitas-M small molecule compound

2-{(E)-[(3-phenyl-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)imino]methyl}benzoic acid

Catalog ID
STL149483
SMILES OC(=O)c1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccc1

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H12N4O2S MW 324.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4O2S/c21-15(22)13-9-5-4-8-12(13)10-17-20-14(18-19-16(20)23)11-6-2-1-3-7-11/h1-10H,(H,19,23)(H,21,22)/b17-10+
InChIKey
IHTCRKMFCXCVRX-LICLKQGHSA-N
Synonyms
380454-42-2
2((1E)2(5PHENYL3SULFANYL(124TRIAZOL4YL))2AZAVINYL)BENZOICACID
2((E)((3phenyl5thioxo15dihydro4H124triazol4yl)imino)methyl)benzoicacid
2((E)(3PHENYL5SULFANYLIDENE1H124TRIAZOL4YL)IMINOMETHYL)BENZOICACID
380454422
C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC=CC=C3C(=O)O
InChI=1SC16H12N4O2Sc2115(22)13954812(13)10172014(181916(20)23)116213711h110H(H1923)(H2122)b1710+
MFCD03804101
ZINC000000520328
ZINC33322754

Check stock

See real-time availability and sample size for STL149483 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.