2-(2-ethyl-4-oxidanylidene-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)ethanenitrile

Systemtic Name: 2-(2-ethyl-4-oxidanylidene-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)ethanenitrile Openeye Name: 2-(2-ethyl-4-oxo-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)acetonitrile CAS Name: 2-(2-ethyl-4-oxo-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)acetonitrile IUPAC Name: 2-(2-ethyl-4-oxo-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)acetonitrile Traditional Name: 2-(2-ethyl-4-keto-6,7-dihydro-5H-thieno[2,3-b]thiepin-5-yl)acetonitrile Formula: C12H13NOS2 MolecularWeight: 251.36772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)SCCC(C2=O)CC#N

Isomeric SMILES

CCC1=CC2=C(S1)SCCC(C2=O)CC#N

InChI

InChI=1S/C12H13NOS2/c1-2-9-7-10-11(14)8(3-5-13)4-6-15-12(10)16-9/h7-8H,2-4,6H2,1H3