5-[(2-methoxy-5-nitro-phenyl)methyl]-6-methyl-2-(naphthalen-1-ylamino)-1H-pyrimidin-4-one

Systemtic Name: 5-[(2-methoxy-5-nitro-phenyl)methyl]-6-methyl-2-(naphthalen-1-ylamino)-1H-pyrimidin-4-one Openeye Name: 5-[(2-methoxy-5-nitro-phenyl)methyl]-6-methyl-2-(1-naphthylamino)-1H-pyrimidin-4-one CAS Name: 5-[(2-methoxy-5-nitrophenyl)methyl]-6-methyl-2-(1-naphthalenylamino)-1H-pyrimidin-4-one IUPAC Name: 5-[(2-methoxy-5-nitrophenyl)methyl]-6-methyl-2-(naphthalen-1-ylamino)-1H-pyrimidin-4-one Traditional Name: 5-(2-methoxy-5-nitro-benzyl)-6-methyl-2-(1-naphthylamino)-1H-pyrimidin-4-one Formula: C23H20N4O4 MolecularWeight: 416.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NC2=CC=CC3=CC=CC=C32)CC4=C(C=CC(=C4)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NC2=CC=CC3=CC=CC=C32)CC4=C(C=CC(=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C23H20N4O4/c1-14-19(13-16-12-17(27(29)30)10-11-21(16)31-2)22(28)26-23(24-14)25-20-9-5-7-15-6-3-4-8-18(15)20/h3-12H,13H2,1-2H3,(H2,24,25,26,28)