N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[4-(methylsulfamoylmethyl)benzyl]-5-nitro-benzothiophene-2-carboxamide Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O5S2/c1-19-28(25,26)11-13-4-2-12(3-5-13)10-20-18(22)17-9-14-8-15(21(23)24)6-7-16(14)27-17/h2-9,19H,10-11H2,1H3,(H,20,22)