2-[(4-butylphenyl)amino]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(4-butylphenyl)amino]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-(4-butylanilino)-6-propyl-1H-pyrimidin-4-one CAS Name: 2-(4-butylanilino)-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-(4-butylanilino)-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-(4-butylanilino)-6-propyl-1H-pyrimidin-4-one Formula: C17H23N3O MolecularWeight: 285.38402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC(=O)C=C(N2)CCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC(=O)C=C(N2)CCC

InChI

InChI=1S/C17H23N3O/c1-3-5-7-13-8-10-14(11-9-13)18-17-19-15(6-4-2)12-16(21)20-17/h8-12H,3-7H2,1-2H3,(H2,18,19,20,21)