N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-2,3-dihydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-2,3-dihydro-1-benzothiophene-2-carboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-2,3-dihydrobenzothiophene-2-carboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-2,3-dihydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]-2,3-dihydro-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-pyrrolidino-phenyl]-2,3-dihydrobenzothiophene-2-carboxamide Formula: C23H29N3O3S2 MolecularWeight: 459.62466

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3CC4=CC=CC=C4S3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3CC4=CC=CC=C4S3

InChI

InChI=1S/C23H29N3O3S2/c1-3-26(4-2)31(28,29)18-11-12-20(25-13-7-8-14-25)19(16-18)24-23(27)22-15-17-9-5-6-10-21(17)30-22/h5-6,9-12,16,22H,3-4,7-8,13-15H2,1-2H3,(H,24,27)