(5R,6R)-1,3-dimethyl-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarbonitrile

Systemtic Name: (5R,6R)-1,3-dimethyl-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarbonitrile Openeye Name: (5R,6R)-1,3-dimethyl-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarbonitrile CAS Name: (5R,6R)-1,3-dimethyl-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarbonitrile IUPAC Name: (5R,6R)-1,3-dimethyl-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarbonitrile Traditional Name: (5R,6R)-1,3-dimethyl-4,5,6,7-tetrahydroisobenzothiophene-5,6-dicarbonitrile Formula: C12H12N2S MolecularWeight: 216.30208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CC(C(CC2=C(S1)C)C#N)C#N

Isomeric SMILES

CC1=C2C[C@H]([C@@H](CC2=C(S1)C)C#N)C#N

InChI

InChI=1S/C12H12N2S/c1-7-11-3-9(5-13)10(6-14)4-12(11)8(2)15-7/h9-10H,3-4H2,1-2H3/t9-,10-/m0/s1