2-oxidanylidene-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-3,4-dihydro-1H-quinoline-6-sulfonamide

Systemtic Name: 2-oxidanylidene-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-3,4-dihydro-1H-quinoline-6-sulfonamide Openeye Name: 2-oxo-N-[2-(2-thienylmethylsulfanyl)ethyl]-3,4-dihydro-1H-quinoline-6-sulfonamide CAS Name: 2-oxo-N-[2-(thiophen-2-ylmethylthio)ethyl]-3,4-dihydro-1H-quinoline-6-sulfonamide IUPAC Name: 2-oxo-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-3,4-dihydro-1H-quinoline-6-sulfonamide Traditional Name: 2-keto-N-[2-(2-thenylthio)ethyl]-3,4-dihydro-1H-quinoline-6-sulfonamide Formula: C16H18N2O3S3 MolecularWeight: 382.52072

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)NCCSCC3=CC=CS3

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)NCCSCC3=CC=CS3

InChI

InChI=1S/C16H18N2O3S3/c19-16-6-3-12-10-14(4-5-15(12)18-16)24(20,21)17-7-9-22-11-13-2-1-8-23-13/h1-2,4-5,8,10,17H,3,6-7,9,11H2,(H,18,19)