propan-2-yl 3-butyl-4-methyl-2-oxidanylidene-6-[3-[(4-pentylphenyl)carbonylamino]phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 3-butyl-4-methyl-2-oxidanylidene-6-[3-[(4-pentylphenyl)carbonylamino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 3-butyl-4-methyl-2-oxo-6-[3-[(4-pentylbenzoyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-4-methyl-2-oxo-6-[3-[[oxo-(4-pentylphenyl)methyl]amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-butyl-4-methyl-2-oxo-6-[3-[(4-pentylbenzoyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(4-amylbenzoyl)amino]phenyl]-3-butyl-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C31H41N3O4 MolecularWeight: 519.67494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3C(=C(N(C(=O)N3)CCCC)C)C(=O)OC(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3C(=C(N(C(=O)N3)CCCC)C)C(=O)OC(C)C

InChI

InChI=1S/C31H41N3O4/c1-6-8-10-12-23-15-17-24(18-16-23)29(35)32-26-14-11-13-25(20-26)28-27(30(36)38-21(3)4)22(5)34(19-9-7-2)31(37)33-28/h11,13-18,20-21,28H,6-10,12,19H2,1-5H3,(H,32,35)(H,33,37)