N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-phenyl-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-5-phenyl-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C19H16N2O4S3 MolecularWeight: 432.53634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(SCCO3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(SCCO3)C4=CC=CC=C4

InChI

InChI=1S/C19H16N2O4S3/c1-28(23,24)13-7-8-14-15(11-13)27-19(20-14)21-18(22)16-17(26-10-9-25-16)12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3,(H,20,21,22)