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

Systemtic Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-1-yl)phenyl]-3-nitro-benzamide Openeye Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-1-yl)phenyl]-3-nitro-benzamide CAS Name: N-[5-(diethylsulfamoyl)-2-(4-ethyl-1-piperazinyl)phenyl]-3-nitrobenzamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-1-yl)phenyl]-3-nitrobenzamide Traditional Name: N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazino)phenyl]-3-nitro-benzamide Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H31N5O5S/c1-4-25-12-14-26(15-13-25)22-11-10-20(34(32,33)27(5-2)6-3)17-21(22)24-23(29)18-8-7-9-19(16-18)28(30)31/h7-11,16-17H,4-6,12-15H2,1-3H3,(H,24,29)