2-[4-[4-(tert-butylsulfamoyl)-2-nitro-phenyl]piperazin-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-[4-(tert-butylsulfamoyl)-2-nitro-phenyl]piperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[4-(tert-butylsulfamoyl)-2-nitro-phenyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[4-(tert-butylsulfamoyl)-2-nitrophenyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-[4-(tert-butylsulfamoyl)-2-nitrophenyl]piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[4-(tert-butylsulfamoyl)-2-nitro-phenyl]piperazino]acetamide Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H31N5O5S/c1-23(2,3)25-34(32,33)19-9-10-20(21(15-19)28(30)31)27-13-11-26(12-14-27)17-22(29)24-16-18-7-5-4-6-8-18/h4-10,15,25H,11-14,16-17H2,1-3H3,(H,24,29)