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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CCC3=CC=CC=C3)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CCC3=CC=CC=C3)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C31H33N3O4/c1-3-20-34-29(23-14-9-6-10-15-23)27(30(36)38-4-2)28(33-31(34)37)24-16-11-17-25(21-24)32-26(35)19-18-22-12-7-5-8-13-22/h5-17,21,28H,3-4,18-20H2,1-2H3,(H,32,35)(H,33,37)