N4-ethyl-N6-methyl-N4-(3-methylphenyl)-N6-(1-methylpiperidin-4-yl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-ethyl-N6-methyl-N4-(3-methylphenyl)-N6-(1-methylpiperidin-4-yl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-ethyl-N6-methyl-N6-(1-methyl-4-piperidyl)-N4-(m-tolyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-ethyl-N6-methyl-N4-(3-methylphenyl)-N6-(1-methyl-4-piperidinyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-ethyl-6-N-methyl-4-N-(3-methylphenyl)-6-N-(1-methylpiperidin-4-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: ethyl-[6-[methyl-(1-methyl-4-piperidyl)amino]-5-nitro-pyrimidin-4-yl]-(m-tolyl)amine Formula: C20H28N6O2 MolecularWeight: 384.47532

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)N(C)C3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)N(C)C3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H28N6O2/c1-5-25(17-8-6-7-15(2)13-17)20-18(26(27)28)19(21-14-22-20)24(4)16-9-11-23(3)12-10-16/h6-8,13-14,16H,5,9-12H2,1-4H3