3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-chloranyl-4-methyl-phenyl)propane-1-sulfonamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-chloranyl-4-methyl-phenyl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-chloro-4-methyl-phenyl)propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(3-chloro-4-methylphenyl)-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-chloro-4-methylphenyl)propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(3-chloro-4-methyl-phenyl)propane-1-sulfonamide Formula: C17H17ClN2O2S3 MolecularWeight: 412.97708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H17ClN2O2S3/c1-12-7-8-13(11-14(12)18)20-25(21,22)10-4-9-23-17-19-15-5-2-3-6-16(15)24-17/h2-3,5-8,11,20H,4,9-10H2,1H3