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

Systemtic Name: ethyl 3-butyl-6-[3-(3,3-dimethylbutanoylamino)phenyl]-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-6-[3-(3,3-dimethylbutanoylamino)phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[3-[(3,3-dimethyl-1-oxobutyl)amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-6-[3-(3,3-dimethylbutanoylamino)phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[3-(3,3-dimethylbutanoylamino)phenyl]-2-keto-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H37N3O4 MolecularWeight: 491.62178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37N3O4/c1-6-8-17-32-26(20-13-10-9-11-14-20)24(27(34)36-7-2)25(31-28(32)35)21-15-12-16-22(18-21)30-23(33)19-29(3,4)5/h9-16,18,25H,6-8,17,19H2,1-5H3,(H,30,33)(H,31,35)