Vitas-M small molecule compound
3-{[4-amino-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-2-oxopropanoic acid
Catalog ID
STK803553
SMILES Cc1ccc(cc1)c1nnc(n1N)SCC(=O)C(=O)O
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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/c1-7-2-4-8(5-3-7)10-14-15-12(16(10)13)20-6-9(17)11(18)19/h2-5H,6,13H2,1H3,(H,18,19)InChIKey
TUCGUMXIIXQWTL-UHFFFAOYSA-NSynonyms
3((4amino5(4methylphenyl)124triazol3yl)sulfanyl)2oxopropanoicacid
3((4amino5(4methylphenyl)4H124triazol3yl)sulfanyl)2oxopropanoicacid
CC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)C(=O)O
InChI=1SC12H12N4O3Sc17248(537)10141512(16(10)13)2069(17)11(18)19h25H613H21H3(H1819)
MFCD13372729
ZINC000015017270
ZINC15017270
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