4-[5-[1-(4-butylcyclohexyl)cyclohexyl]thieno[3,2-b]thiophen-2-yl]benzenecarbonitrile

Systemtic Name: 4-[5-[1-(4-butylcyclohexyl)cyclohexyl]thieno[3,2-b]thiophen-2-yl]benzenecarbonitrile Openeye Name: 4-[5-[1-(4-butylcyclohexyl)cyclohexyl]thieno[3,2-b]thiophen-2-yl]benzonitrile CAS Name: 4-[5-[1-(4-butylcyclohexyl)cyclohexyl]-2-thieno[3,2-b]thiophenyl]benzonitrile IUPAC Name: 4-[5-[1-(4-butylcyclohexyl)cyclohexyl]thieno[3,2-b]thiophen-2-yl]benzonitrile Traditional Name: 4-[5-[1-(4-butylcyclohexyl)cyclohexyl]thieno[3,2-b]thiophen-2-yl]benzonitrile Formula: C29H35NS2 MolecularWeight: 461.7249

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2(CCCCC2)C3=CC4=C(S3)C=C(S4)C5=CC=C(C=C5)C#N

Isomeric SMILES

CCCCC1CCC(CC1)C2(CCCCC2)C3=CC4=C(S3)C=C(S4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H35NS2/c1-2-3-7-21-10-14-24(15-11-21)29(16-5-4-6-17-29)28-19-27-26(32-28)18-25(31-27)23-12-8-22(20-30)9-13-23/h8-9,12-13,18-19,21,24H,2-7,10-11,14-17H2,1H3