N-[2-(4-ethylpiperazin-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]-3-nitro-benzamide

Systemtic Name: N-[2-(4-ethylpiperazin-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]-3-nitro-benzamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)-5-(1-piperidylsulfonyl)phenyl]-3-nitro-benzamide CAS Name: N-[2-(4-ethyl-1-piperazinyl)-5-(1-piperidinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: N-[2-(4-ethylpiperazin-1-yl)-5-piperidin-1-ylsulfonylphenyl]-3-nitrobenzamide Traditional Name: N-[2-(4-ethylpiperazino)-5-piperidinosulfonyl-phenyl]-3-nitro-benzamide Formula: C24H31N5O5S MolecularWeight: 501.59844

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H31N5O5S/c1-2-26-13-15-27(16-14-26)23-10-9-21(35(33,34)28-11-4-3-5-12-28)18-22(23)25-24(30)19-7-6-8-20(17-19)29(31)32/h6-10,17-18H,2-5,11-16H2,1H3,(H,25,30)