Vitas-M small molecule compound

3-({[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoic acid

Catalog ID
STL182743
SMILES O=C(Nc1cccc(c1)C(=O)O)CSc1nncn1C

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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/c1-16-7-13-15-12(16)20-6-10(17)14-9-4-2-3-8(5-9)11(18)19/h2-5,7H,6H2,1H3,(H,14,17)(H,18,19)
InChIKey
RDOYILDEAZBWGZ-UHFFFAOYSA-N
Synonyms
511284-39-2
3((((4methyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
3((2((4METHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
3(2((4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZOICACID
3(2(4METHYL4H(124)TRIAZOL3YLSULFANYL)ACETYLAMINO)BENZOICACID
511284392
CN1C=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)O
InChI=1SC12H12N4O3Sc1167131512(16)20610(17)1494238(59)11(18)19h257H6H21H3(H1417)(H1819)
MFCD03771461
ZINC000003269560
ZINC3269560

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Available files

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