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

Systemtic Name: ethyl 3-butyl-2-oxidanylidene-4-phenyl-6-[3-(2-phenylethanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-2-oxo-4-phenyl-6-[3-[(2-phenylacetyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-2-oxo-6-[3-[(1-oxo-2-phenylethyl)amino]phenyl]-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-2-oxo-4-phenyl-6-[3-[(2-phenylacetyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-2-keto-4-phenyl-6-[3-[(2-phenylacetyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C31H33N3O4 MolecularWeight: 511.61142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CC3=CC=CC=C3)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CC3=CC=CC=C3)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C31H33N3O4/c1-3-5-19-34-29(23-15-10-7-11-16-23)27(30(36)38-4-2)28(33-31(34)37)24-17-12-18-25(21-24)32-26(35)20-22-13-8-6-9-14-22/h6-18,21,28H,3-5,19-20H2,1-2H3,(H,32,35)(H,33,37)