2-(2,3-dimethylbut-2-enyl)-2H-thiochromene-4-carbonitrile

Systemtic Name: 2-(2,3-dimethylbut-2-enyl)-2H-thiochromene-4-carbonitrile Openeye Name: 2-(2,3-dimethylbut-2-enyl)-2H-thiochromene-4-carbonitrile CAS Name: 2-(2,3-dimethylbut-2-enyl)-2H-1-benzothiopyran-4-carbonitrile IUPAC Name: 2-(2,3-dimethylbut-2-enyl)-2H-thiochromene-4-carbonitrile Traditional Name: 2-(2,3-dimethylbut-2-enyl)-2H-thiochromene-4-carbonitrile Formula: C16H17NS MolecularWeight: 255.37788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)CC1C=C(C2=CC=CC=C2S1)C#N)C

Isomeric SMILES

CC(=C(C)CC1C=C(C2=CC=CC=C2S1)C#N)C

InChI

InChI=1S/C16H17NS/c1-11(2)12(3)8-14-9-13(10-17)15-6-4-5-7-16(15)18-14/h4-7,9,14H,8H2,1-3H3