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

Systemtic Name: 4-[4-(diethylsulfamoyl)-2-nitro-phenyl]-N-(phenylmethyl)piperazine-1-carboxamide Openeye Name: N-benzyl-4-[4-(diethylsulfamoyl)-2-nitro-phenyl]piperazine-1-carboxamide CAS Name: 4-[4-(diethylsulfamoyl)-2-nitrophenyl]-N-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-benzyl-4-[4-(diethylsulfamoyl)-2-nitrophenyl]piperazine-1-carboxamide Traditional Name: N-benzyl-4-[4-(diethylsulfamoyl)-2-nitro-phenyl]piperazine-1-carboxamide Formula: C22H29N5O5S MolecularWeight: 475.56116

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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=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H29N5O5S/c1-3-26(4-2)33(31,32)19-10-11-20(21(16-19)27(29)30)24-12-14-25(15-13-24)22(28)23-17-18-8-6-5-7-9-18/h5-11,16H,3-4,12-15,17H2,1-2H3,(H,23,28)