Vitas-M small molecule compound
4,4'-[(E)-ethene-1,2-diylbis({5-[(phenylcarbonyl)amino]benzene-2,1-diyl}sulfonylimino)]dibenzoic acid
Catalog ID
STK366142
SMILES O=C(c1ccccc1)Nc1ccc(c(c1)S(=O)(=O)Nc1ccc(cc1)C(=O)O)/C=C/c1ccc(cc1S(=O)(=O)Nc1ccc(cc1)C(=O)O)NC(=O)c1ccccc1
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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 C42H32N4O10S2 MW 816.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H32N4O10S2/c47-39(29-7-3-1-4-8-29)43-35-23-13-27(37(25-35)57(53,54)45-33-19-15-31(16-20-33)41(49)50)11-12-28-14-24-36(44-40(48)30-9-5-2-6-10-30)26-38(28)58(55,56)46-34-21-17-32(18-22-34)42(51)52/h1-26,45-46H,(H,43,47)(H,44,48)(H,49,50)(H,51,52InChIKey
TXZPRGMAOALXHD-VAWYXSNFSA-NSynonyms
4(((2((1E)2(2(((4CARBOXYPHENYL)AMINO)SULFONYL)4(PHENYLCARBONYLAMINO)PHENYL)VINYL)5(PHENYLCARBONYLAMINO)PHENYL)SULFONYL)AMINO)BENZOICACID
4((5BENZAMIDO2((E)2(4BENZAMIDO2((4CARBOXYPHENYL)SULFAMOYL)PHENYL)ETHENYL)PHENYL)SULFONYLAMINO)BENZOICACID
44((E)ethene12diylbis((5((phenylcarbonyl)amino)benzene21diyl)sulfonylimino))dibenzoicacid
C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4)S(=O)(=O)NC5=CC=C(C=C5)C(=O)O)S(=O)(=O)NC6=CC=C(C=C6)C(=O)O
InChI=1SC42H32N4O10S2c4739(297314829)4335231327(37(2535)57(5354)4533191531(162033)41(49)50)111228142436(4440(48)3095261030)2638(28)58(5556)4634211732(182234)42(51)52h1264546H(H4347)(H4448)(H4950)(H5152)b1211+
MFCD00308259
O=C(c1ccccc1)Nc1ccc(c(c1)S(=O)(=O)Nc1ccc(cc1)C(=O)O)C=Cc1ccc(cc1S(=O)(=O)Nc1ccc(cc1)C(=O)O)NC(=O)c1ccccc1
ZINC000097965535
ZINC97965535
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