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

Systemtic Name: propan-2-yl 4-methyl-2-oxidanylidene-6-[3-[(4-pentylphenyl)carbonylamino]phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 4-methyl-2-oxo-6-[3-[(4-pentylbenzoyl)amino]phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-2-oxo-6-[3-[[oxo-(4-pentylphenyl)methyl]amino]phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-2-oxo-6-[3-[(4-pentylbenzoyl)amino]phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(4-amylbenzoyl)amino]phenyl]-2-keto-4-methyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C30H39N3O4 MolecularWeight: 505.64836

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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)CCC)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)CCC)C)C(=O)OC(C)C

InChI

InChI=1S/C30H39N3O4/c1-6-8-9-11-22-14-16-23(17-15-22)28(34)31-25-13-10-12-24(19-25)27-26(29(35)37-20(3)4)21(5)33(18-7-2)30(36)32-27/h10,12-17,19-20,27H,6-9,11,18H2,1-5H3,(H,31,34)(H,32,36)