(E)-2-(1,3-dimethyl-5,6-dihydro-4H-2-benzothiophen-1-yl)but-2-enedinitrile

Systemtic Name: (E)-2-(1,3-dimethyl-5,6-dihydro-4H-2-benzothiophen-1-yl)but-2-enedinitrile Openeye Name: (E)-2-(1,3-dimethyl-5,6-dihydro-4H-2-benzothiophen-1-yl)but-2-enedinitrile CAS Name: (E)-2-(1,3-dimethyl-5,6-dihydro-4H-2-benzothiophen-1-yl)-2-butenedinitrile IUPAC Name: (E)-2-(1,3-dimethyl-5,6-dihydro-4H-2-benzothiophen-1-yl)but-2-enedinitrile Traditional Name: (E)-2-(1,3-dimethyl-5,6-dihydro-4H-isobenzothiophen-1-yl)but-2-enedinitrile Formula: C14H14N2S MolecularWeight: 242.33936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCC=C2C(S1)(C)C(=CC#N)C#N

Isomeric SMILES

CC1=C2CCCC=C2C(S1)(C)/C(=C/C#N)/C#N

InChI

InChI=1S/C14H14N2S/c1-10-12-5-3-4-6-13(12)14(2,17-10)11(9-16)7-8-15/h6-7H,3-5H2,1-2H3/b11-7+