Vitas-M small molecule compound
4-({[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoic acid
Catalog ID
STK328476
SMILES O=C(Nc1ccc(cc1)C(=O)O)CSc1nnc([nH]1)C
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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 C12H12N4O3S MW 292.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O3S/c1-7-13-12(16-15-7)20-6-10(17)14-9-4-2-8(3-5-9)11(18)19/h2-5H,6H2,1H3,(H,14,17)(H,18,19)(H,13,15,16)InChIKey
ZDAWBHLKHKTFHS-UHFFFAOYSA-NSynonyms
696622-85-24((((5methyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
4((2((5METHYL1H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
4(2((5methyl4H124triazol3yl)thio)acetamido)benzoicacid
696622852
CC1=NC(=NN1)SCC(=O)NC2=CC=C(C=C2)C(=O)O
InChI=1SC12H12N4O3Sc171312(16157)20610(17)149428(359)11(18)19h25H6H21H3(H1417)(H1819)(H131516)
MFCD05854277
O=C(Nc1ccc(cc1)C(=O)O)CSc1nnc((nH)1)C
ZINC000009012398
ZINC9012398
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