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

Systemtic Name: 5-[(2-methoxy-5-nitro-phenyl)methyl]-6-methyl-2-(pyridin-2-ylamino)-1H-pyrimidin-4-one Openeye Name: 5-[(2-methoxy-5-nitro-phenyl)methyl]-6-methyl-2-(2-pyridylamino)-1H-pyrimidin-4-one CAS Name: 5-[(2-methoxy-5-nitrophenyl)methyl]-6-methyl-2-(2-pyridinylamino)-1H-pyrimidin-4-one IUPAC Name: 5-[(2-methoxy-5-nitrophenyl)methyl]-6-methyl-2-(pyridin-2-ylamino)-1H-pyrimidin-4-one Traditional Name: 5-(2-methoxy-5-nitro-benzyl)-6-methyl-2-(2-pyridylamino)-1H-pyrimidin-4-one Formula: C18H17N5O4 MolecularWeight: 367.35868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NC2=CC=CC=N2)CC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NC2=CC=CC=N2)CC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H17N5O4/c1-11-14(10-12-9-13(23(25)26)6-7-15(12)27-2)17(24)22-18(20-11)21-16-5-3-4-8-19-16/h3-9H,10H2,1-2H3,(H2,19,20,21,22,24)