4-(4-chloranyl-2-nitro-phenyl)-N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-chloranyl-2-nitro-phenyl)-N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]piperazine-1-carboxamide Openeye Name: 4-(4-chloro-2-nitro-phenyl)-N-[[5-(dimethylsulfamoyl)-2-thienyl]methyl]piperazine-1-carboxamide CAS Name: 4-(4-chloro-2-nitrophenyl)-N-[[5-(dimethylsulfamoyl)-2-thiophenyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-chloro-2-nitrophenyl)-N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]piperazine-1-carboxamide Traditional Name: 4-(4-chloro-2-nitro-phenyl)-N-[[5-(dimethylsulfamoyl)-2-thienyl]methyl]piperazine-1-carboxamide Formula: C18H22ClN5O5S2 MolecularWeight: 487.98078

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(S1)CNC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(S1)CNC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H22ClN5O5S2/c1-21(2)31(28,29)17-6-4-14(30-17)12-20-18(25)23-9-7-22(8-10-23)15-5-3-13(19)11-16(15)24(26)27/h3-6,11H,7-10,12H2,1-2H3,(H,20,25)