6-(4-methylpiperazin-1-yl)-5-nitro-N-(2-phenoxyethyl)pyrimidin-4-amine

Systemtic Name: 6-(4-methylpiperazin-1-yl)-5-nitro-N-(2-phenoxyethyl)pyrimidin-4-amine Openeye Name: 6-(4-methylpiperazin-1-yl)-5-nitro-N-(2-phenoxyethyl)pyrimidin-4-amine CAS Name: 6-(4-methyl-1-piperazinyl)-5-nitro-N-(2-phenoxyethyl)-4-pyrimidinamine IUPAC Name: 6-(4-methylpiperazin-1-yl)-5-nitro-N-(2-phenoxyethyl)pyrimidin-4-amine Traditional Name: [6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]-(2-phenoxyethyl)amine Formula: C17H22N6O3 MolecularWeight: 358.39498

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC=N2)NCCOC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC=N2)NCCOC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H22N6O3/c1-21-8-10-22(11-9-21)17-15(23(24)25)16(19-13-20-17)18-7-12-26-14-5-3-2-4-6-14/h2-6,13H,7-12H2,1H3,(H,18,19,20)