N-[3-[3-(dimethylaminomethyl)-4-oxidanyl-phenyl]propylsulfonyl]thiophene-2-sulfonamide

Systemtic Name: N-[3-[3-(dimethylaminomethyl)-4-oxidanyl-phenyl]propylsulfonyl]thiophene-2-sulfonamide Openeye Name: N-[3-[3-(dimethylaminomethyl)-4-hydroxy-phenyl]propylsulfonyl]thiophene-2-sulfonamide CAS Name: N-[3-[3-(dimethylaminomethyl)-4-hydroxyphenyl]propylsulfonyl]-2-thiophenesulfonamide IUPAC Name: N-[3-[3-(dimethylaminomethyl)-4-hydroxyphenyl]propylsulfonyl]thiophene-2-sulfonamide Traditional Name: N-[3-[3-(dimethylaminomethyl)-4-hydroxy-phenyl]propylsulfonyl]thiophene-2-sulfonamide Formula: C16H22N2O5S3 MolecularWeight: 418.55128

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C=CC(=C1)CCCS(=O)(=O)NS(=O)(=O)C2=CC=CS2)O

Isomeric SMILES

CN(C)CC1=C(C=CC(=C1)CCCS(=O)(=O)NS(=O)(=O)C2=CC=CS2)O

InChI

InChI=1S/C16H22N2O5S3/c1-18(2)12-14-11-13(7-8-15(14)19)5-4-10-25(20,21)17-26(22,23)16-6-3-9-24-16/h3,6-9,11,17,19H,4-5,10,12H2,1-2H3