3-(1,3-benzothiazol-2-ylsulfanyl)-N-ethyl-N-(3-methylphenyl)propane-1-sulfonamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-ethyl-N-(3-methylphenyl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-ethyl-N-(m-tolyl)propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-ethyl-N-(3-methylphenyl)-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-ethyl-N-(3-methylphenyl)propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-ethyl-N-(m-tolyl)propane-1-sulfonamide Formula: C19H22N2O2S3 MolecularWeight: 406.58518

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)S(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)S(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H22N2O2S3/c1-3-21(16-9-6-8-15(2)14-16)26(22,23)13-7-12-24-19-20-17-10-4-5-11-18(17)25-19/h4-6,8-11,14H,3,7,12-13H2,1-2H3