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

Systemtic Name: bis[[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl]cyanamide Openeye Name: bis[[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]sulfanyl]cyanamide CAS Name: N-cyano-2-(3,4-dimethoxyphenyl)-N-[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]thio]-2-oxoethanesulfenamide IUPAC Name: bis[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl]cyanamide Traditional Name: bis[[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]thio]cyanamide Formula: C21H22N2O6S2 MolecularWeight: 462.53918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O6S2/c1-26-18-7-5-14(9-20(18)28-3)16(24)11-30-23(13-22)31-12-17(25)15-6-8-19(27-2)21(10-15)29-4/h5-10H,11-12H2,1-4H3