5-[(4-ethylphenyl)methyl]-6-methyl-2-[(4-methylphenyl)amino]-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-[(4-methylphenyl)amino]-1H-pyrimidin-4-one Openeye Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-(4-methylanilino)-1H-pyrimidin-4-one CAS Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-(4-methylanilino)-1H-pyrimidin-4-one IUPAC Name: 5-[(4-ethylphenyl)methyl]-6-methyl-2-(4-methylanilino)-1H-pyrimidin-4-one Traditional Name: 5-(4-ethylbenzyl)-6-methyl-2-(p-toluidino)-1H-pyrimidin-4-one Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=C(NC(=NC2=O)NC3=CC=C(C=C3)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=C(NC(=NC2=O)NC3=CC=C(C=C3)C)C

InChI

InChI=1S/C21H23N3O/c1-4-16-7-9-17(10-8-16)13-19-15(3)22-21(24-20(19)25)23-18-11-5-14(2)6-12-18/h5-12H,4,13H2,1-3H3,(H2,22,23,24,25)