5,6-dimethyl-1-oxidanylidene-3a,4,7,7a-tetrahydro-1,2-benzothiazol-3-one

Systemtic Name: 5,6-dimethyl-1-oxidanylidene-3a,4,7,7a-tetrahydro-1,2-benzothiazol-3-one Openeye Name: 5,6-dimethyl-1-oxo-3a,4,7,7a-tetrahydro-1,2-benzothiazol-3-one CAS Name: 5,6-dimethyl-1-oxo-3a,4,7,7a-tetrahydro-1,2-benzothiazol-3-one IUPAC Name: 5,6-dimethyl-1-oxo-3a,4,7,7a-tetrahydro-1,2-benzothiazol-3-one Traditional Name: 1-keto-5,6-dimethyl-3a,4,7,7a-tetrahydro-1,2-benzothiazol-3-one Formula: C9H13NO2S MolecularWeight: 199.27002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC2C(C1)C(=O)NS2=O)C

Isomeric SMILES

CC1=C(CC2C(C1)C(=O)NS2=O)C

InChI

InChI=1S/C9H13NO2S/c1-5-3-7-8(4-6(5)2)13(12)10-9(7)11/h7-8H,3-4H2,1-2H3,(H,10,11)