N-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-3-(phenylsulfonylamino)propanamide

Systemtic Name: N-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-3-(phenylsulfonylamino)propanamide Openeye Name: 3-(benzenesulfonamido)-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(benzenesulfonamido)-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(benzenesulfonamido)-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(benzenesulfonamido)-N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)propionamide Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)CCNS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)CCNS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C18H21N3O4S2/c1-18(2)10-13-16(14(22)11-18)26-17(20-13)21-15(23)8-9-19-27(24,25)12-6-4-3-5-7-12/h3-7,19H,8-11H2,1-2H3,(H,20,21,23)