Vitas-M small molecule compound
2-({[1-(2-carboxybenzyl)-1H-benzimidazol-2-yl]sulfanyl}methyl)benzoic acid
Catalog ID
STK685112
SMILES OC(=O)c1ccccc1CSc1nc2c(n1Cc1ccccc1C(=O)O)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 C23H18N2O4S MW 418.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O4S/c26-21(27)17-9-3-1-7-15(17)13-25-20-12-6-5-11-19(20)24-23(25)30-14-16-8-2-4-10-18(16)22(28)29/h1-12H,13-14H2,(H,26,27)(H,28,29)InChIKey
VEHAWJOIDCNYLT-UHFFFAOYSA-NSynonyms
2(((1(2carboxybenzyl)1Hbenzimidazol2yl)sulfanyl)methyl)benzoicacid2(((1(2CARBOXYBENZYL)1HBENZIMIDAZOL2YL)THIO)METHYL)BENZOICACID
2((2((2CARBOXYPHENYL)METHYLSULFANYL)BENZIMIDAZOL1YL)METHYL)BENZOICACID
C1=CC=C(C(=C1)CN2C3=CC=CC=C3N=C2SCC4=CC=CC=C4C(=O)O)C(=O)O
Registry IDs
MFCD05857390ZINC000001428387
ZINC1428387
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