N6-methyl-N6-(1-methylpiperidin-4-yl)-5-nitro-N4-(phenylmethyl)-N4-pyridin-2-yl-pyrimidine-4,6-diamine

Systemtic Name: N6-methyl-N6-(1-methylpiperidin-4-yl)-5-nitro-N4-(phenylmethyl)-N4-pyridin-2-yl-pyrimidine-4,6-diamine Openeye Name: N4-benzyl-N6-methyl-N6-(1-methyl-4-piperidyl)-5-nitro-N4-(2-pyridyl)pyrimidine-4,6-diamine CAS Name: N6-methyl-N6-(1-methyl-4-piperidinyl)-5-nitro-N4-(phenylmethyl)-N4-(2-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-6-N-methyl-6-N-(1-methylpiperidin-4-yl)-5-nitro-4-N-pyridin-2-ylpyrimidine-4,6-diamine Traditional Name: benzyl-[6-[methyl-(1-methyl-4-piperidyl)amino]-5-nitro-pyrimidin-4-yl]-(2-pyridyl)amine Formula: C23H27N7O2 MolecularWeight: 433.50618

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C2=NC=NC(=C2[N+](=O)[O-])N(CC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

CN1CCC(CC1)N(C)C2=NC=NC(=C2[N+](=O)[O-])N(CC3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C23H27N7O2/c1-27-14-11-19(12-15-27)28(2)22-21(30(31)32)23(26-17-25-22)29(20-10-6-7-13-24-20)16-18-8-4-3-5-9-18/h3-10,13,17,19H,11-12,14-16H2,1-2H3