Vitas-M small molecule compound
2-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}benzoic acid
Catalog ID
STK292797
SMILES O=C(Nc1ccccc1C(=O)O)CSc1nc2c([nH]1)cccc2
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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 C16H13N3O3S MW 327.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O3S/c20-14(17-11-6-2-1-5-10(11)15(21)22)9-23-16-18-12-7-3-4-8-13(12)19-16/h1-8H,9H2,(H,17,20)(H,18,19)(H,21,22)InChIKey
OBWDUCSFLJKFLV-UHFFFAOYSA-NSynonyms
313980-58-42(((1Hbenzimidazol2ylsulfanyl)acetyl)amino)benzoicacid
2((2(1HBENZIMIDAZOL2YLSULFANYL)ACETYL)AMINO)BENZOICACID
2(2(1HBENZOIMIDAZOL2YLSULFANYL)ACETYLAMINO)BENZOICACID
313980584
C1=CC=C(C(=C1)C(=O)O)NC(=O)CSC2=NC3=CC=CC=C3N2
InChI=1SC16H13N3O3Sc2014(1711621510(11)15(21)22)923161812734813(12)1916h18H9H2(H1720)(H1819)(H2122)
MFCD00627567
O=C(Nc1ccccc1C(=O)O)CSc1nc2c((nH)1)cccc2
ZINC000000819852
ZINC819852
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