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

Systemtic Name: 5-[5-(4-nonylcyclohexyl)-1,3-dioxan-2-yl]thieno[2,3-b]thiophene-2-carbonitrile Openeye Name: 5-[5-(4-nonylcyclohexyl)-1,3-dioxan-2-yl]thieno[2,3-b]thiophene-2-carbonitrile CAS Name: 5-[5-(4-nonylcyclohexyl)-1,3-dioxan-2-yl]-2-thieno[2,3-b]thiophenecarbonitrile IUPAC Name: 5-[5-(4-nonylcyclohexyl)-1,3-dioxan-2-yl]thieno[2,3-b]thiophene-2-carbonitrile Traditional Name: 5-[5-(4-nonylcyclohexyl)-1,3-dioxan-2-yl]thieno[2,3-b]thiophene-2-carbonitrile Formula: C26H37NO2S2 MolecularWeight: 459.70748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(CC1)C2COC(OC2)C3=CC4=C(S3)SC(=C4)C#N

Isomeric SMILES

CCCCCCCCCC1CCC(CC1)C2COC(OC2)C3=CC4=C(S3)SC(=C4)C#N

InChI

InChI=1S/C26H37NO2S2/c1-2-3-4-5-6-7-8-9-19-10-12-20(13-11-19)22-17-28-25(29-18-22)24-15-21-14-23(16-27)30-26(21)31-24/h14-15,19-20,22,25H,2-13,17-18H2,1H3