3-pyrrolidin-1-ylsulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]benzamide

Systemtic Name: 3-pyrrolidin-1-ylsulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]benzamide Openeye Name: 3-pyrrolidin-1-ylsulfonyl-N-[2-(2-thienylmethylsulfanyl)ethyl]benzamide CAS Name: 3-(1-pyrrolidinylsulfonyl)-N-[2-(thiophen-2-ylmethylthio)ethyl]benzamide IUPAC Name: 3-pyrrolidin-1-ylsulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]benzamide Traditional Name: 3-pyrrolidinosulfonyl-N-[2-(2-thenylthio)ethyl]benzamide Formula: C18H22N2O3S3 MolecularWeight: 410.57388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCSCC3=CC=CS3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCSCC3=CC=CS3

InChI

InChI=1S/C18H22N2O3S3/c21-18(19-8-12-24-14-16-6-4-11-25-16)15-5-3-7-17(13-15)26(22,23)20-9-1-2-10-20/h3-7,11,13H,1-2,8-10,12,14H2,(H,19,21)