Vitas-M small molecule compound
bis[4-({3-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]phenyl}carbamoyl)phenyl] benzene-1,4-dicarboxylate
Catalog ID
STK018412
SMILES O=C(c1ccc(cc1)C(=O)Oc1ccc(cc1)C(=O)Nc1cccc(c1)/C=C/C(=O)c1ccccc1)Oc1ccc(cc1)C(=O)Nc1cccc(c1)/C=C/C(=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 C52H36N2O8 MW 816.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C52H36N2O8/c55-47(37-11-3-1-4-12-37)31-17-35-9-7-15-43(33-35)53-49(57)39-23-27-45(28-24-39)61-51(59)41-19-21-42(22-20-41)52(60)62-46-29-25-40(26-30-46)50(58)54-44-16-8-10-36(34-44)18-32-48(56)38-13-5-2-6-14-38/h1-34H,(H,53,57)(H,54,58)/b31-17+,32InChIKey
YNJOBDJJKZJWIH-LTTYKRRRSA-NSynonyms
BIS(4((3((1E)3OXO3PHENYLPROP1EN1YL)PHENYL)CARBAMOYL)PHENYL)BENZENE14DICARBOXYLATE
bis(4((3((E)3oxo3phenylprop1enyl)phenyl)carbamoyl)phenyl)benzene14dicarboxylate
C1=CC=C(C=C1)C(=O)C=CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)C(=O)OC5=CC=C(C=C5)C(=O)NC6=CC=CC(=C6)C=CC(=O)C7=CC=CC=C7
InChI=1SC52H36N2O8c5547(37113141237)311735971543(3335)5349(57)39232745(282439)6151(59)41192142(222041)52(60)6246292540(263046)50(58)54441681036(3444)183248(56)38135261438h134H(H5357)(H5458)b3117+3218+
MFCD00635175
O=C(c1ccc(cc1)C(=O)Oc1ccc(cc1)C(=O)Nc1cccc(c1)C=CC(=O)c1ccccc1)Oc1ccc(cc1)C(=O)Nc1cccc(c1)C=CC(=O)c1ccccc1
STK018412
ZINC000097957994
ZINC97957994
Check stock
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