bis[[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl]methylidenecyanamide

Systemtic Name: bis[[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl]methylidenecyanamide Openeye Name: bis[[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]sulfanyl]methylenecyanamide CAS Name: bis[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]thio]methylidenecyanamide IUPAC Name: bis[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl]methylidenecyanamide Traditional Name: bis[[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]thio]methylenecyanamide Formula: C22H22N2O6S2 MolecularWeight: 474.54988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC(=NC#N)SCC(=O)C2=CC(=C(C=C2)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC(=NC#N)SCC(=O)C2=CC(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C22H22N2O6S2/c1-27-18-7-5-14(9-20(18)29-3)16(25)11-31-22(24-13-23)32-12-17(26)15-6-8-19(28-2)21(10-15)30-4/h5-10H,11-12H2,1-4H3