5-[(4-methoxy-3-nitro-phenyl)methyl]-6-methyl-2-[(4-methylphenyl)amino]-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-methoxy-3-nitro-phenyl)methyl]-6-methyl-2-[(4-methylphenyl)amino]-1H-pyrimidin-4-one Openeye Name: 5-[(4-methoxy-3-nitro-phenyl)methyl]-6-methyl-2-(4-methylanilino)-1H-pyrimidin-4-one CAS Name: 5-[(4-methoxy-3-nitrophenyl)methyl]-6-methyl-2-(4-methylanilino)-1H-pyrimidin-4-one IUPAC Name: 5-[(4-methoxy-3-nitrophenyl)methyl]-6-methyl-2-(4-methylanilino)-1H-pyrimidin-4-one Traditional Name: 5-(4-methoxy-3-nitro-benzyl)-6-methyl-2-(p-toluidino)-1H-pyrimidin-4-one Formula: C20H20N4O4 MolecularWeight: 380.3972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=O)C(=C(N2)C)CC3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=O)C(=C(N2)C)CC3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-12-4-7-15(8-5-12)22-20-21-13(2)16(19(25)23-20)10-14-6-9-18(28-3)17(11-14)24(26)27/h4-9,11H,10H2,1-3H3,(H2,21,22,23,25)