5-[bis(2,4-dimethoxyphenyl)methyl]-2-sulfanylidene-1,3-dithiole-4-carbaldehyde

Systemtic Name: 5-[bis(2,4-dimethoxyphenyl)methyl]-2-sulfanylidene-1,3-dithiole-4-carbaldehyde Openeye Name: 5-[bis(2,4-dimethoxyphenyl)methyl]-2-thioxo-1,3-dithiole-4-carbaldehyde CAS Name: 5-[bis(2,4-dimethoxyphenyl)methyl]-2-sulfanylidene-1,3-dithiole-4-carboxaldehyde IUPAC Name: 5-[bis(2,4-dimethoxyphenyl)methyl]-2-sulfanylidene-1,3-dithiole-4-carbaldehyde Traditional Name: 5-[bis(2,4-dimethoxyphenyl)methyl]-2-thioxo-1,3-dithiole-4-carbaldehyde Formula: C21H20O5S3 MolecularWeight: 448.5755

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(C2=C(C=C(C=C2)OC)OC)C3=C(SC(=S)S3)C=O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(C2=C(C=C(C=C2)OC)OC)C3=C(SC(=S)S3)C=O)OC

InChI

InChI=1S/C21H20O5S3/c1-23-12-5-7-14(16(9-12)25-3)19(20-18(11-22)28-21(27)29-20)15-8-6-13(24-2)10-17(15)26-4/h5-11,19H,1-4H3