Vitas-M small molecule compound
4,4'-bis{[(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino}biphenyl-3,3'-dicarboxylic acid
Catalog ID
STK293573
SMILES O=C(Nc1ccc(cc1C(=O)O)c1ccc(c(c1)C(=O)O)NC(=O)CSc1nc2c(o1)cccc2)CSc1nc2c(o1)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 C32H22N4O8S2 MW 654.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H22N4O8S2/c37-27(15-45-31-35-23-5-1-3-7-25(23)43-31)33-21-11-9-17(13-19(21)29(39)40)18-10-12-22(20(14-18)30(41)42)34-28(38)16-46-32-36-24-6-2-4-8-26(24)44-32/h1-14H,15-16H2,(H,33,37)(H,34,38)(H,39,40)(H,41,42)InChIKey
FOAPYCMDISQLAS-UHFFFAOYSA-NSynonyms
2((2(13benzoxazol2ylsulfanyl)acetyl)amino)5(4((2(13benzoxazol2ylsulfanyl)acetyl)amino)3carboxyphenyl)benzoicacid
44bis(((13benzoxazol2ylsulfanyl)acetyl)amino)biphenyl33dicarboxylicacid
C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=C(C=C(C=C3)C4=CC(=C(C=C4)NC(=O)CSC5=NC6=CC=CC=C6O5)C(=O)O)C(=O)O
InChI=1SC32H22N4O8S2c3727(1545313523513725(23)4331)332111917(1319(21)29(39)40)18101222(20(1418)30(41)42)3428(38)1646323624624826(24)4432h114H1516H2(H3337)(H3438)(H3940)(H4142)
MFCD09697525
ZINC000097994890
ZINC97994890
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