4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylphenyl)butane-1-sulfonamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylphenyl)butane-1-sulfonamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(o-tolyl)butane-1-sulfonamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-(2-methylphenyl)-1-butanesulfonamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methylphenyl)butane-1-sulfonamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-(o-tolyl)butane-1-sulfonamide Formula: C18H20N2O2S3 MolecularWeight: 392.5586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)CCCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)CCCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H20N2O2S3/c1-14-8-2-3-9-15(14)20-25(21,22)13-7-6-12-23-18-19-16-10-4-5-11-17(16)24-18/h2-5,8-11,20H,6-7,12-13H2,1H3