4-[4-(diethylsulfamoyl)-2-nitro-phenyl]-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-[4-(diethylsulfamoyl)-2-nitro-phenyl]-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-[4-(diethylsulfamoyl)-2-nitro-phenyl]-N-(p-tolylmethyl)piperazine-1-carboxamide CAS Name: 4-[4-(diethylsulfamoyl)-2-nitrophenyl]-N-[(4-methylphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-[4-(diethylsulfamoyl)-2-nitrophenyl]-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide Traditional Name: 4-[4-(diethylsulfamoyl)-2-nitro-phenyl]-N-(4-methylbenzyl)piperazine-1-carboxamide Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N5O5S/c1-4-27(5-2)34(32,33)20-10-11-21(22(16-20)28(30)31)25-12-14-26(15-13-25)23(29)24-17-19-8-6-18(3)7-9-19/h6-11,16H,4-5,12-15,17H2,1-3H3,(H,24,29)