ethyl 4-[[5-[(4-cyclohexylphenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoate

Systemtic Name: ethyl 4-[[5-[(4-cyclohexylphenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoate Openeye Name: ethyl 4-[[5-[(4-cyclohexylphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoate CAS Name: 4-[[5-[(4-cyclohexylphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-[(4-cyclohexylphenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoate Traditional Name: 4-[[5-(4-cyclohexylbenzyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]amino]benzoic acid ethyl ester Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=O)C(=C(N2)C)CC3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=O)C(=C(N2)C)CC3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C27H31N3O3/c1-3-33-26(32)22-13-15-23(16-14-22)29-27-28-18(2)24(25(31)30-27)17-19-9-11-21(12-10-19)20-7-5-4-6-8-20/h9-16,20H,3-8,17H2,1-2H3,(H2,28,29,30,31)