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

Systemtic Name: ethyl 3-butyl-6-[3-(cyclobutylcarbonylamino)phenyl]-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-6-[3-(cyclobutanecarbonylamino)phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[3-[[cyclobutyl(oxo)methyl]amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-6-[3-(cyclobutanecarbonylamino)phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[3-(cyclobutanecarbonylamino)phenyl]-2-keto-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C28H33N3O4 MolecularWeight: 475.57932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3CCC3)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3CCC3)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C28H33N3O4/c1-3-5-17-31-25(19-11-7-6-8-12-19)23(27(33)35-4-2)24(30-28(31)34)21-15-10-16-22(18-21)29-26(32)20-13-9-14-20/h6-8,10-12,15-16,18,20,24H,3-5,9,13-14,17H2,1-2H3,(H,29,32)(H,30,34)