Vitas-M small molecule compound
3-({[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetyl}amino)benzoic acid
Catalog ID
STL199042
SMILES O=C(Nc1cccc(c1)C(=O)O)CSc1nccn1C
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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 C13H13N3O3S MW 291.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O3S/c1-16-6-5-14-13(16)20-8-11(17)15-10-4-2-3-9(7-10)12(18)19/h2-7H,8H2,1H3,(H,15,17)(H,18,19)InChIKey
CULBPTFMVCRTBL-UHFFFAOYSA-NSynonyms
3((((1methyl1Himidazol2yl)sulfanyl)acetyl)amino)benzoicacid
3((2(1methylimidazol2yl)sulfanylacetyl)amino)benzoicacid
CN1C=CN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)O
InChI=1SC13H13N3O3Sc116651413(16)20811(17)15104239(710)12(18)19h27H8H21H3(H1517)(H1819)
MFCD09871712
ZINC000008025903
ZINC8025903
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