Vitas-M small molecule compound
ethyl 4-{[11-(3,4-dihydroxyphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-yl]amino}benzoate
Catalog ID
STL042348
SMILES CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)O)O)c(nn1c1ccccc1)C
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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 C34H28N6O4 MW 584.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28N6O4/c1-3-44-34(43)21-13-16-23(17-14-21)35-31-33-37-32-29(20(2)38-40(32)24-9-5-4-6-10-24)30(22-15-18-27(41)28(42)19-22)39(33)26-12-8-7-11-25(26)36-31/h4-19,30,41-42H,3H2,1-2H3,(H,35,36)InChIKey
CVCYHSGZTMTEKN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N4C2=NC5=C(C4C6=CC(=C(C=C6)O)O)C(=NN5C7=CC=CC=C7)C
ethyl4((11(34dihydroxyphenyl)10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin6yl)amino)benzoate
InChI=1SC34H28N6O4c134434(43)21131623(171421)353133373229(20(2)3840(32)2495461024)30(22151827(41)28(42)1922)39(33)2612871125(26)3631h419304142H3H212H3(H3536)
MFCD03676775
ZINC000002593264
ZINC000102870560
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