3-methyl-2-oxidanylidene-N-[(4-phenyloxan-4-yl)methyl]-1,3-benzothiazole-6-sulfonamide

Systemtic Name: 3-methyl-2-oxidanylidene-N-[(4-phenyloxan-4-yl)methyl]-1,3-benzothiazole-6-sulfonamide Openeye Name: 3-methyl-2-oxo-N-[(4-phenyltetrahydropyran-4-yl)methyl]-1,3-benzothiazole-6-sulfonamide CAS Name: 3-methyl-2-oxo-N-[(4-phenyl-4-oxanyl)methyl]-1,3-benzothiazole-6-sulfonamide IUPAC Name: 3-methyl-2-oxo-N-[(4-phenyloxan-4-yl)methyl]-1,3-benzothiazole-6-sulfonamide Traditional Name: 2-keto-3-methyl-N-[(4-phenyltetrahydropyran-4-yl)methyl]-1,3-benzothiazole-6-sulfonamide Formula: C20H22N2O4S2 MolecularWeight: 418.52968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NCC3(CCOCC3)C4=CC=CC=C4)SC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NCC3(CCOCC3)C4=CC=CC=C4)SC1=O

InChI

InChI=1S/C20H22N2O4S2/c1-22-17-8-7-16(13-18(17)27-19(22)23)28(24,25)21-14-20(9-11-26-12-10-20)15-5-3-2-4-6-15/h2-8,13,21H,9-12,14H2,1H3