N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)sulfonyl-ethanamide

Systemtic Name: N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-2-(p-tolylsulfonyl)acetamide CAS Name: N-[3-methyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]-2-(4-methylphenyl)sulfonylacetamide IUPAC Name: N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-2-(4-methylphenyl)sulfonylacetamide Traditional Name: N-[3-methyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]-2-tosyl-acetamide Formula: C18H18N2O3S3 MolecularWeight: 406.54212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)SC)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)SC)C

InChI

InChI=1S/C18H18N2O3S3/c1-12-4-7-14(8-5-12)26(22,23)11-17(21)19-18-20(2)15-9-6-13(24-3)10-16(15)25-18/h4-10H,11H2,1-3H3