Vitas-M small molecule compound
N-[4-hydroxy-2-methyl-5-(propan-2-yl)phenyl]-7,7-dimethyl-1-(4-methylphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STL447859
SMILES Cc1ccc(cc1)n1c2CC(C)(C)CC(=O)c2cc(c1=O)C(=O)Nc1cc(C(C)C)c(cc1C)O
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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 C29H32N2O4 MW 472.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O4/c1-16(2)20-13-23(18(4)11-25(20)32)30-27(34)22-12-21-24(14-29(5,6)15-26(21)33)31(28(22)35)19-9-7-17(3)8-10-19/h7-13,16,32H,14-15H2,1-6H3,(H,30,34)InChIKey
OHEQGABPCGBEQZ-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N2C3=C(C=C(C2=O)C(=O)NC4=C(C=C(C(=C4)C(C)C)O)C)C(=O)CC(C3)(C)C
InChI=1SC29H32N2O4c116(2)201323(18(4)1125(20)32)3027(34)22122124(1429(56)1526(21)33)31(28(22)35)199717(3)81019h7131632H1415H216H3(H3034)
MFCD07756065
N(4hydroxy2methyl5(propan2yl)phenyl)77dimethyl1(4methylphenyl)25dioxo125678hexahydroquinoline3carboxamide
N(4HYDROXY2METHYL5PROPAN2YLPHENYL)77DIMETHYL1(4METHYLPHENYL)25DIOXO68DIHYDROQUINOLINE3CARBOXAMIDE
ZINC000008757286
ZINC8757286
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