N4-methyl-N6-(4-methylpiperazin-1-yl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N4-methyl-N6-(4-methylpiperazin-1-yl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N4-methyl-N6-(4-methylpiperazin-1-yl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: N4-methyl-N6-(4-methyl-1-piperazinyl)-5-nitro-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 4-N-methyl-6-N-(4-methylpiperazin-1-yl)-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: methyl-[6-[(4-methylpiperazino)amino]-5-nitro-pyrimidin-4-yl]-phenyl-amine Formula: C16H21N7O2 MolecularWeight: 343.38364

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC2=C(C(=NC=N2)N(C)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)NC2=C(C(=NC=N2)N(C)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N7O2/c1-20-8-10-22(11-9-20)19-15-14(23(24)25)16(18-12-17-15)21(2)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H,17,18,19)