1,3-diphenyl-2-benzothiophene-5,6-dicarbonitrile

Systemtic Name: 1,3-diphenyl-2-benzothiophene-5,6-dicarbonitrile Openeye Name: 1,3-diphenyl-2-benzothiophene-5,6-dicarbonitrile CAS Name: 1,3-diphenyl-2-benzothiophene-5,6-dicarbonitrile IUPAC Name: 1,3-diphenyl-2-benzothiophene-5,6-dicarbonitrile Traditional Name: 1,3-diphenylisobenzothiophene-5,6-dicarbonitrile Formula: C22H12N2S MolecularWeight: 336.40908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C(=CC3=C(S2)C4=CC=CC=C4)C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C(=CC3=C(S2)C4=CC=CC=C4)C#N)C#N

InChI

InChI=1S/C22H12N2S/c23-13-17-11-19-20(12-18(17)14-24)22(16-9-5-2-6-10-16)25-21(19)15-7-3-1-4-8-15/h1-12H