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

Systemtic Name: ethyl 6-[3-(cyclohexylcarbonylamino)phenyl]-2-oxidanylidene-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-(cyclohexanecarbonylamino)phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[[cyclohexyl(oxo)methyl]amino]phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-(cyclohexanecarbonylamino)phenyl]-2-oxo-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-(cyclohexanecarbonylamino)phenyl]-2-keto-4-phenyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H35N3O4 MolecularWeight: 489.6059

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3CCCCC3)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3CCCCC3)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C29H35N3O4/c1-3-18-32-26(20-12-7-5-8-13-20)24(28(34)36-4-2)25(31-29(32)35)22-16-11-17-23(19-22)30-27(33)21-14-9-6-10-15-21/h5,7-8,11-13,16-17,19,21,25H,3-4,6,9-10,14-15,18H2,1-2H3,(H,30,33)(H,31,35)