2,5-dimethyl-4-oxidanylidene-7,8-dihydro-6H-cyclohepta[b]thiophene-5-carbonitrile

Systemtic Name: 2,5-dimethyl-4-oxidanylidene-7,8-dihydro-6H-cyclohepta[b]thiophene-5-carbonitrile Openeye Name: 2,5-dimethyl-4-oxo-7,8-dihydro-6H-cyclohepta[b]thiophene-5-carbonitrile CAS Name: 2,5-dimethyl-4-oxo-7,8-dihydro-6H-cyclohepta[b]thiophene-5-carbonitrile IUPAC Name: 2,5-dimethyl-4-oxo-7,8-dihydro-6H-cyclohepta[b]thiophene-5-carbonitrile Traditional Name: 4-keto-2,5-dimethyl-7,8-dihydro-6H-cyclohepta[b]thiophene-5-carbonitrile Formula: C12H13NOS MolecularWeight: 219.30272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)CCCC(C2=O)(C)C#N

Isomeric SMILES

CC1=CC2=C(S1)CCCC(C2=O)(C)C#N

InChI

InChI=1S/C12H13NOS/c1-8-6-9-10(15-8)4-3-5-12(2,7-13)11(9)14/h6H,3-5H2,1-2H3