N4-methyl-N6-(4-methylpyridin-2-yl)-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-methyl-N6-(4-methylpyridin-2-yl)-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-benzyl-N4-methyl-N6-(4-methyl-2-pyridyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-methyl-N6-(4-methyl-2-pyridinyl)-5-nitro-N4-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-4-N-methyl-6-N-(4-methylpyridin-2-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: benzyl-methyl-[6-[(4-methyl-2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N6O2/c1-13-8-9-19-15(10-13)22-17-16(24(25)26)18(21-12-20-17)23(2)11-14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3,(H,19,20,21,22)