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

Systemtic Name: ethyl 3-butyl-4-methyl-2-oxidanylidene-6-[3-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-4-methyl-2-oxo-6-[3-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-4-methyl-2-oxo-6-[3-[(1-oxo-2-phenylbutyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-4-methyl-2-oxo-6-[3-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-2-keto-4-methyl-6-[3-(2-phenylbutanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O4/c1-5-8-17-31-19(4)24(27(33)35-7-3)25(30-28(31)34)21-15-12-16-22(18-21)29-26(32)23(6-2)20-13-10-9-11-14-20/h9-16,18,23,25H,5-8,17H2,1-4H3,(H,29,32)(H,30,34)