6,6-dimethyl-3-(2-methyl-2-sulfanyl-propyl)-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carbothioamide

Systemtic Name: 6,6-dimethyl-3-(2-methyl-2-sulfanyl-propyl)-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carbothioamide Openeye Name: 6,6-dimethyl-3-(2-methyl-2-sulfanyl-propyl)-4-oxo-5,7-dihydro-2-benzothiophene-1-carbothioamide CAS Name: 3-(2-mercapto-2-methylpropyl)-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carbothioamide IUPAC Name: 6,6-dimethyl-3-(2-methyl-2-sulfanylpropyl)-4-oxo-5,7-dihydro-2-benzothiophene-1-carbothioamide Traditional Name: 4-keto-3-(2-mercapto-2-methyl-propyl)-6,6-dimethyl-5,7-dihydroisobenzothiophene-1-carbothioamide Formula: C15H21NOS3 MolecularWeight: 327.52834

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(SC(=C2C(=O)C1)CC(C)(C)S)C(=S)N)C

Isomeric SMILES

CC1(CC2=C(SC(=C2C(=O)C1)CC(C)(C)S)C(=S)N)C

InChI

InChI=1S/C15H21NOS3/c1-14(2)5-8-11(9(17)6-14)10(7-15(3,4)19)20-12(8)13(16)18/h19H,5-7H2,1-4H3,(H2,16,18)