1-(6,8-dimethyl-2,3-dihydro-1,4-benzodioxin-5-yl)-4-(1,3-dithian-2-ylidene)cyclohexane-1-carbonitrile

Systemtic Name: 1-(6,8-dimethyl-2,3-dihydro-1,4-benzodioxin-5-yl)-4-(1,3-dithian-2-ylidene)cyclohexane-1-carbonitrile Openeye Name: 1-(6,8-dimethyl-2,3-dihydro-1,4-benzodioxin-5-yl)-4-(1,3-dithian-2-ylidene)cyclohexanecarbonitrile CAS Name: 1-(6,8-dimethyl-2,3-dihydro-1,4-benzodioxin-5-yl)-4-(1,3-dithian-2-ylidene)-1-cyclohexanecarbonitrile IUPAC Name: 1-(6,8-dimethyl-2,3-dihydro-1,4-benzodioxin-5-yl)-4-(1,3-dithian-2-ylidene)cyclohexane-1-carbonitrile Traditional Name: 1-(6,8-dimethyl-2,3-dihydro-1,4-benzodioxin-5-yl)-4-(1,3-dithian-2-ylidene)cyclohexanecarbonitrile Formula: C21H25NO2S2 MolecularWeight: 387.5587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1C3(CCC(=C4SCCCS4)CC3)C#N)OCCO2)C

Isomeric SMILES

CC1=CC(=C2C(=C1C3(CCC(=C4SCCCS4)CC3)C#N)OCCO2)C

InChI

InChI=1S/C21H25NO2S2/c1-14-12-15(2)18-19(24-9-8-23-18)17(14)21(13-22)6-4-16(5-7-21)20-25-10-3-11-26-20/h12H,3-11H2,1-2H3