2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-methylphenyl)sulfonyl-ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(p-tolylsulfonyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(4-methylphenyl)sulfonylacetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-methylphenyl)sulfonylacetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-tosyl-acetamide Formula: C16H14N2O3S3 MolecularWeight: 378.48896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H14N2O3S3/c1-11-6-8-12(9-7-11)24(20,21)18-15(19)10-22-16-17-13-4-2-3-5-14(13)23-16/h2-9H,10H2,1H3,(H,18,19)