5-(5-nonyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-2-carbonitrile

Systemtic Name: 5-(5-nonyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-2-carbonitrile Openeye Name: 5-(5-nonyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-2-carbonitrile CAS Name: 5-(5-nonyl-1,3-dioxan-2-yl)-2-thieno[2,3-b]thiophenecarbonitrile IUPAC Name: 5-(5-nonyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-2-carbonitrile Traditional Name: 5-(5-nonyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-2-carbonitrile Formula: C20H27NO2S2 MolecularWeight: 377.56388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1COC(OC1)C2=CC3=C(S2)SC(=C3)C#N

Isomeric SMILES

CCCCCCCCCC1COC(OC1)C2=CC3=C(S2)SC(=C3)C#N

InChI

InChI=1S/C20H27NO2S2/c1-2-3-4-5-6-7-8-9-15-13-22-19(23-14-15)18-11-16-10-17(12-21)24-20(16)25-18/h10-11,15,19H,2-9,13-14H2,1H3