N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-ethanamide

Systemtic Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-(p-tolylsulfonyl)acetamide CAS Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-(4-methylphenyl)sulfonylacetamide IUPAC Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-(4-methylphenyl)sulfonylacetamide Traditional Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-tosyl-acetamide Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=NC3=C(S2)CCC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=NC3=C(S2)CCC4=CC=CC=C43

InChI

InChI=1S/C20H18N2O3S2/c1-13-6-9-15(10-7-13)27(24,25)12-18(23)21-20-22-19-16-5-3-2-4-14(16)8-11-17(19)26-20/h2-7,9-10H,8,11-12H2,1H3,(H,21,22,23)