5-chloranyl-3-methyl-N-(4-propylsulfonylphenyl)-1-benzothiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-3-methyl-N-(4-propylsulfonylphenyl)-1-benzothiophene-2-sulfonamide Openeye Name: 5-chloro-3-methyl-N-(4-propylsulfonylphenyl)benzothiophene-2-sulfonamide CAS Name: 5-chloro-3-methyl-N-(4-propylsulfonylphenyl)-1-benzothiophene-2-sulfonamide IUPAC Name: 5-chloro-3-methyl-N-(4-propylsulfonylphenyl)-1-benzothiophene-2-sulfonamide Traditional Name: 5-chloro-3-methyl-N-(4-propylsulfonylphenyl)benzothiophene-2-sulfonamide Formula: C18H18ClNO4S3 MolecularWeight: 443.98782

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C3=C(S2)C=CC(=C3)Cl)C

Isomeric SMILES

CCCS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C3=C(S2)C=CC(=C3)Cl)C

InChI

InChI=1S/C18H18ClNO4S3/c1-3-10-26(21,22)15-7-5-14(6-8-15)20-27(23,24)18-12(2)16-11-13(19)4-9-17(16)25-18/h4-9,11,20H,3,10H2,1-2H3