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

Systemtic Name: ethyl 3-butyl-4-methyl-2-oxidanylidene-6-[4-[(4-pentylphenyl)carbonylamino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-4-methyl-2-oxo-6-[4-[(4-pentylbenzoyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-4-methyl-2-oxo-6-[4-[[oxo-(4-pentylphenyl)methyl]amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-4-methyl-2-oxo-6-[4-[(4-pentylbenzoyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[4-[(4-amylbenzoyl)amino]phenyl]-3-butyl-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl 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=C(C=C2)C3C(=C(N(C(=O)N3)CCCC)C)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C30H39N3O4/c1-5-8-10-11-22-12-14-24(15-13-22)28(34)31-25-18-16-23(17-19-25)27-26(29(35)37-7-3)21(4)33(20-9-6-2)30(36)32-27/h12-19,27H,5-11,20H2,1-4H3,(H,31,34)(H,32,36)