4-(4-methylpiperidin-1-yl)-3-nitro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 4-(4-methylpiperidin-1-yl)-3-nitro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Openeye Name: 4-(4-methyl-1-piperidyl)-3-nitro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide CAS Name: 4-(4-methyl-1-piperidinyl)-3-nitro-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]benzamide IUPAC Name: 4-(4-methylpiperidin-1-yl)-3-nitro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Traditional Name: 4-(4-methylpiperidino)-3-nitro-N-[3-[4-(2-pyrimidyl)piperazino]propyl]benzamide Formula: C24H33N7O3 MolecularWeight: 467.56392

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C24H33N7O3/c1-19-6-12-29(13-7-19)21-5-4-20(18-22(21)31(33)34)23(32)25-10-3-11-28-14-16-30(17-15-28)24-26-8-2-9-27-24/h2,4-5,8-9,18-19H,3,6-7,10-17H2,1H3,(H,25,32)