6,6-dimethyl-3-(2-methylpropyl)-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carbonitrile

Systemtic Name: 6,6-dimethyl-3-(2-methylpropyl)-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carbonitrile Openeye Name: 3-isobutyl-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carbonitrile CAS Name: 6,6-dimethyl-3-(2-methylpropyl)-4-oxo-5,7-dihydro-2-benzothiophene-1-carbonitrile IUPAC Name: 6,6-dimethyl-3-(2-methylpropyl)-4-oxo-5,7-dihydro-2-benzothiophene-1-carbonitrile Traditional Name: 3-isobutyl-4-keto-6,6-dimethyl-5,7-dihydroisobenzothiophene-1-carbonitrile Formula: C15H19NOS MolecularWeight: 261.38246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C2C(=C(S1)C#N)CC(CC2=O)(C)C

Isomeric SMILES

CC(C)CC1=C2C(=C(S1)C#N)CC(CC2=O)(C)C

InChI

InChI=1S/C15H19NOS/c1-9(2)5-12-14-10(13(8-16)18-12)6-15(3,4)7-11(14)17/h9H,5-7H2,1-4H3