N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-4-methylsulfonyl-benzamide

Systemtic Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-4-methylsulfonyl-benzamide Openeye Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-4-methylsulfonyl-benzamide CAS Name: N-(1-methyl-2-benzo[e][1,3]benzothiazolylidene)-4-methylsulfonylbenzamide IUPAC Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-4-methylsulfonylbenzamide Traditional Name: 4-mesyl-N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)benzamide Formula: C20H16N2O3S2 MolecularWeight: 396.48264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N2O3S2/c1-22-18-16-6-4-3-5-13(16)9-12-17(18)26-20(22)21-19(23)14-7-10-15(11-8-14)27(2,24)25/h3-12H,1-2H3