N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]-5-nitro-benzothiophene-2-carboxamide Formula: C18H17N3O6S2 MolecularWeight: 435.47408

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O6S2/c1-20(2)29(25,26)13-5-6-15(27-3)14(10-13)19-18(22)17-9-11-8-12(21(23)24)4-7-16(11)28-17/h4-10H,1-3H3,(H,19,22)