6-(4-methylpiperidin-1-yl)-5-nitro-N2-phenethyl-pyrimidine-2,4-diamine

Systemtic Name: 6-(4-methylpiperidin-1-yl)-5-nitro-N2-phenethyl-pyrimidine-2,4-diamine Openeye Name: 6-(4-methyl-1-piperidyl)-5-nitro-N2-phenethyl-pyrimidine-2,4-diamine CAS Name: 6-(4-methyl-1-piperidinyl)-5-nitro-N2-phenethylpyrimidine-2,4-diamine IUPAC Name: 6-(4-methylpiperidin-1-yl)-5-nitro-2-N-phenethylpyrimidine-2,4-diamine Traditional Name: [4-amino-6-(4-methylpiperidino)-5-nitro-pyrimidin-2-yl]-phenethyl-amine Formula: C18H24N6O2 MolecularWeight: 356.42216

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=NC(=N2)NCCC3=CC=CC=C3)N)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=NC(=N2)NCCC3=CC=CC=C3)N)[N+](=O)[O-]

InChI

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