2-[(3-nitrophenyl)methylamino]-6-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[(3-nitrophenyl)methylamino]-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-[(3-nitrophenyl)methylamino]-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-[(3-nitrophenyl)methylamino]-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-[(3-nitrophenyl)methylamino]-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-[(3-nitrobenzyl)amino]-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=NC(=O)C=C(N2)C3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=NC(=O)C=C(N2)C3=CC=NC=C3

InChI

InChI=1S/C16H13N5O3/c22-15-9-14(12-4-6-17-7-5-12)19-16(20-15)18-10-11-2-1-3-13(8-11)21(23)24/h1-9H,10H2,(H2,18,19,20,22)