2-methyl-3-nitro-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide

Systemtic Name: 2-methyl-3-nitro-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Openeye Name: 2-methyl-3-nitro-N-[3-[4-(2-pyridyl)piperazin-1-yl]sulfonylpropyl]benzamide CAS Name: 2-methyl-3-nitro-N-[3-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]propyl]benzamide IUPAC Name: 2-methyl-3-nitro-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Traditional Name: 2-methyl-3-nitro-N-[3-[4-(2-pyridyl)piperazino]sulfonylpropyl]benzamide Formula: C20H25N5O5S MolecularWeight: 447.508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C20H25N5O5S/c1-16-17(6-4-7-18(16)25(27)28)20(26)22-10-5-15-31(29,30)24-13-11-23(12-14-24)19-8-2-3-9-21-19/h2-4,6-9H,5,10-15H2,1H3,(H,22,26)