ethyl 3-butyl-6-[3-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]phenyl]-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-butyl-6-[3-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]phenyl]-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-6-[3-[(4-ethoxy-4-oxo-butanoyl)amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[3-[(4-ethoxy-1,4-dioxobutyl)amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-6-[3-[(4-ethoxy-4-oxobutanoyl)amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[3-[(4-ethoxy-4-keto-butanoyl)amino]phenyl]-2-keto-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H35N3O6 MolecularWeight: 521.6047

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CCC(=O)OCC)C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CCC(=O)OCC)C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C29H35N3O6/c1-4-7-18-32-27(20-12-9-8-10-13-20)25(28(35)38-6-3)26(31-29(32)36)21-14-11-15-22(19-21)30-23(33)16-17-24(34)37-5-2/h8-15,19,26H,4-7,16-18H2,1-3H3,(H,30,33)(H,31,36)