2-[(3-morpholin-4-ylsulfonylphenyl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[(3-morpholin-4-ylsulfonylphenyl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[(3-morpholinosulfonylphenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[[3-(4-morpholinylsulfonyl)phenyl]methyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[(3-morpholin-4-ylsulfonylphenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-(3-morpholinosulfonylbenzyl)-1,2-benzothiazol-3-one Formula: C18H18N2O6S2 MolecularWeight: 422.47532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C18H18N2O6S2/c21-18-16-6-1-2-7-17(16)28(24,25)20(18)13-14-4-3-5-15(12-14)27(22,23)19-8-10-26-11-9-19/h1-7,12H,8-11,13H2