5-butyl-6-methyl-2-[(4-phenylphenyl)amino]-1H-pyrimidin-4-one

Systemtic Name: 5-butyl-6-methyl-2-[(4-phenylphenyl)amino]-1H-pyrimidin-4-one Openeye Name: 5-butyl-6-methyl-2-(4-phenylanilino)-1H-pyrimidin-4-one CAS Name: 5-butyl-6-methyl-2-(4-phenylanilino)-1H-pyrimidin-4-one IUPAC Name: 5-butyl-6-methyl-2-(4-phenylanilino)-1H-pyrimidin-4-one Traditional Name: 5-butyl-6-methyl-2-(4-phenylanilino)-1H-pyrimidin-4-one Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=NC1=O)NC2=CC=C(C=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCCCC1=C(NC(=NC1=O)NC2=CC=C(C=C2)C3=CC=CC=C3)C

InChI

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