N4-methyl-5-nitro-N4-phenyl-N6-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-methyl-5-nitro-N4-phenyl-N6-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine Openeye Name: N4-methyl-5-nitro-N4-phenyl-N6-[2-(1-piperidyl)ethyl]pyrimidine-4,6-diamine CAS Name: N4-methyl-5-nitro-N4-phenyl-N6-[2-(1-piperidinyl)ethyl]pyrimidine-4,6-diamine IUPAC Name: 4-N-methyl-5-nitro-4-N-phenyl-6-N-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine Traditional Name: methyl-[5-nitro-6-(2-piperidinoethylamino)pyrimidin-4-yl]-phenyl-amine Formula: C18H24N6O2 MolecularWeight: 356.42216

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCCN3CCCCC3

Isomeric SMILES

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCCN3CCCCC3

InChI

InChI=1S/C18H24N6O2/c1-22(15-8-4-2-5-9-15)18-16(24(25)26)17(20-14-21-18)19-10-13-23-11-6-3-7-12-23/h2,4-5,8-9,14H,3,6-7,10-13H2,1H3,(H,19,20,21)