3-chloranyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)benzothiophene-2-carboxamide Formula: C19H17ClN2O4S2 MolecularWeight: 436.93228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C19H17ClN2O4S2/c20-17-13-5-1-2-6-16(13)27-18(17)19(24)21-14-11-12(7-8-15(14)23)28(25,26)22-9-3-4-10-22/h1-2,5-8,11,23H,3-4,9-10H2,(H,21,24)