N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-2-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-2-(4-methylsulfonylphenyl)ethanamide Openeye Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-2-(4-methylsulfonylphenyl)acetamide CAS Name: N-(1-methyl-2-benzo[e][1,3]benzothiazolylidene)-2-(4-methylsulfonylphenyl)acetamide IUPAC Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-2-(4-methylsulfonylphenyl)acetamide Traditional Name: 2-(4-mesylphenyl)-N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)acetamide Formula: C21H18N2O3S2 MolecularWeight: 410.50922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC3=CC=CC=C32)SC1=NC(=O)CC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CN1C2=C(C=CC3=CC=CC=C32)SC1=NC(=O)CC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C21H18N2O3S2/c1-23-20-17-6-4-3-5-15(17)9-12-18(20)27-21(23)22-19(24)13-14-7-10-16(11-8-14)28(2,25)26/h3-12H,13H2,1-2H3