4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidine

Systemtic Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidine Openeye Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidine CAS Name: 4-[4-(4-methoxyphenyl)-1-piperazinyl]-6-(4-methyl-1-piperazinyl)-5-nitropyrimidine IUPAC Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidine Traditional Name: 4-[4-(4-methoxyphenyl)piperazino]-6-(4-methylpiperazino)-5-nitro-pyrimidine Formula: C20H27N7O3 MolecularWeight: 413.47348

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H27N7O3/c1-23-7-9-25(10-8-23)19-18(27(28)29)20(22-15-21-19)26-13-11-24(12-14-26)16-3-5-17(30-2)6-4-16/h3-6,15H,7-14H2,1-2H3