N4-(3-methylpyridin-2-yl)-5-nitro-N6-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N4-(3-methylpyridin-2-yl)-5-nitro-N6-phenyl-pyrimidine-4,6-diamine Openeye Name: N4-(3-methyl-2-pyridyl)-5-nitro-N6-phenyl-pyrimidine-4,6-diamine CAS Name: N4-(3-methyl-2-pyridinyl)-5-nitro-N6-phenylpyrimidine-4,6-diamine IUPAC Name: 4-N-(3-methylpyridin-2-yl)-5-nitro-6-N-phenylpyrimidine-4,6-diamine Traditional Name: (6-anilino-5-nitro-pyrimidin-4-yl)-(3-methyl-2-pyridyl)amine Formula: C16H14N6O2 MolecularWeight: 322.32136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3

Isomeric SMILES

CC1=C(N=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3

InChI

InChI=1S/C16H14N6O2/c1-11-6-5-9-17-14(11)21-16-13(22(23)24)15(18-10-19-16)20-12-7-3-2-4-8-12/h2-10H,1H3,(H2,17,18,19,20,21)