dimethyl 2,6-diphenyl-4H-1,3-dithiine-4,5-dicarboxylate

Systemtic Name: dimethyl 2,6-diphenyl-4H-1,3-dithiine-4,5-dicarboxylate Openeye Name: dimethyl 2,6-diphenyl-4H-1,3-dithiine-4,5-dicarboxylate CAS Name: 2,6-diphenyl-4H-1,3-dithiin-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,6-diphenyl-4H-1,3-dithiine-4,5-dicarboxylate Traditional Name: 2,6-diphenyl-4H-1,3-dithiin-4,5-dicarboxylic acid dimethyl ester Formula: C20H18O4S2 MolecularWeight: 386.48452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=C(SC(S1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1C(=C(SC(S1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H18O4S2/c1-23-18(21)15-16(13-9-5-3-6-10-13)25-20(14-11-7-4-8-12-14)26-17(15)19(22)24-2/h3-12,17,20H,1-2H3