2-[[5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[[5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[[5-(dimethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[5-(dimethylsulfamoyl)-2-pyrrolidin-1-ylbenzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[5-(dimethylsulfamoyl)-2-pyrrolidino-benzoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H28N4O4S2 MolecularWeight: 476.61212

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)N

InChI

InChI=1S/C22H28N4O4S2/c1-25(2)32(29,30)14-9-10-17(26-11-5-6-12-26)16(13-14)21(28)24-22-19(20(23)27)15-7-3-4-8-18(15)31-22/h9-10,13H,3-8,11-12H2,1-2H3,(H2,23,27)(H,24,28)