5-nitro-4-(4-prop-2-enylpiperazin-1-yl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine

Systemtic Name: 5-nitro-4-(4-prop-2-enylpiperazin-1-yl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine Openeye Name: 4-(4-allylpiperazin-1-yl)-5-nitro-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidine CAS Name: 5-nitro-4-(4-prop-2-enyl-1-piperazinyl)-6-[4-(2-pyridinyl)-1-piperazinyl]pyrimidine IUPAC Name: 5-nitro-4-(4-prop-2-enylpiperazin-1-yl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine Traditional Name: 4-(4-allylpiperazino)-5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidine Formula: C20H26N8O2 MolecularWeight: 410.47284

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C=CCN1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H26N8O2/c1-2-7-24-8-10-26(11-9-24)19-18(28(29)30)20(23-16-22-19)27-14-12-25(13-15-27)17-5-3-4-6-21-17/h2-6,16H,1,7-15H2