N-methyl-5-nitro-N-phenyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine

Systemtic Name: N-methyl-5-nitro-N-phenyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine Openeye Name: N-methyl-5-nitro-N-phenyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine CAS Name: N-methyl-5-nitro-N-phenyl-6-(4-phenyl-1-piperazinyl)-4-pyrimidinamine IUPAC Name: N-methyl-5-nitro-N-phenyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine Traditional Name: methyl-[5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]-phenyl-amine Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N6O2/c1-24(17-8-4-2-5-9-17)20-19(27(28)29)21(23-16-22-20)26-14-12-25(13-15-26)18-10-6-3-7-11-18/h2-11,16H,12-15H2,1H3