Vitas-M small molecule compound
2,5-bis{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}benzoic acid
Catalog ID
STK126304
SMILES O=C(Nc1ccc(c(c1)C(=O)O)NC(=O)CSc1[nH]c2c(n1)cccc2)CSc1[nH]c2c(n1)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 C25H20N6O4S2 MW 532.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N6O4S2/c32-21(12-36-24-28-17-5-1-2-6-18(17)29-24)26-14-9-10-16(15(11-14)23(34)35)27-22(33)13-37-25-30-19-7-3-4-8-20(19)31-25/h1-11H,12-13H2,(H,26,32)(H,27,33)(H,28,29)(H,30,31)(H,34,35)InChIKey
ZRKGWNNJFXYJSS-UHFFFAOYSA-NSynonyms
25BIS(((1HBENZIMIDAZOL2YLSULFANYL)ACETYL)AMINO)BENZOICACID
25BIS((2(1HBENZIMIDAZOL2YLSULFANYL)ACETYL)AMINO)BENZOICACID
C1=CC=C2C(=C1)NC(=N2)SCC(=O)NC3=CC(=C(C=C3)NC(=O)CSC4=NC5=CC=CC=C5N4)C(=O)O
InChI=1SC25H20N6O4S2c3221(1236242817512618(17)2924)261491016(15(1114)23(34)35)2722(33)1337253019734820(19)3125h111H1213H2(H2632)(H2733)(H2829)(H3031)(H3435)
MFCD08675169
O=C(Nc1ccc(c(c1)C(=O)O)NC(=O)CSc1(nH)c2c(n1)cccc2)CSc1(nH)c2c(n1)cccc2
ZINC000098045201
ZINC98045201
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