5-[5-(4-pentylcyclohexyl)-1,3-dioxan-2-yl]thieno[2,3-b]thiophene-2-carbonitrile

Systemtic Name: 5-[5-(4-pentylcyclohexyl)-1,3-dioxan-2-yl]thieno[2,3-b]thiophene-2-carbonitrile Openeye Name: 5-[5-(4-pentylcyclohexyl)-1,3-dioxan-2-yl]thieno[2,3-b]thiophene-2-carbonitrile CAS Name: 5-[5-(4-pentylcyclohexyl)-1,3-dioxan-2-yl]-2-thieno[2,3-b]thiophenecarbonitrile IUPAC Name: 5-[5-(4-pentylcyclohexyl)-1,3-dioxan-2-yl]thieno[2,3-b]thiophene-2-carbonitrile Traditional Name: 5-[5-(4-amylcyclohexyl)-1,3-dioxan-2-yl]thieno[2,3-b]thiophene-2-carbonitrile Formula: C22H29NO2S2 MolecularWeight: 403.60116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2COC(OC2)C3=CC4=C(S3)SC(=C4)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C2COC(OC2)C3=CC4=C(S3)SC(=C4)C#N

InChI

InChI=1S/C22H29NO2S2/c1-2-3-4-5-15-6-8-16(9-7-15)18-13-24-21(25-14-18)20-11-17-10-19(12-23)26-22(17)27-20/h10-11,15-16,18,21H,2-9,13-14H2,1H3