diethyl 5-methyl-4,8-bis(oxidanylidene)-3-phenyl-thieno[3,2-f][1]benzothiole-2,6-dicarboxylate

Systemtic Name: diethyl 5-methyl-4,8-bis(oxidanylidene)-3-phenyl-thieno[3,2-f][1]benzothiole-2,6-dicarboxylate Openeye Name: diethyl 5-methyl-4,8-dioxo-3-phenyl-thieno[3,2-f]benzothiophene-2,6-dicarboxylate CAS Name: 5-methyl-4,8-dioxo-3-phenylthieno[3,2-f][1]benzothiole-2,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-methyl-4,8-dioxo-3-phenylthieno[3,2-f][1]benzothiole-2,6-dicarboxylate Traditional Name: 4,8-diketo-5-methyl-3-phenyl-thieno[3,2-f]benzothiophene-2,6-dicarboxylic acid diethyl ester Formula: C23H18O6S2 MolecularWeight: 454.51542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)C(=O)C3=C(C2=O)C(=C(S3)C(=O)OCC)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)C(=O)C3=C(C2=O)C(=C(S3)C(=O)OCC)C4=CC=CC=C4)C

InChI

InChI=1S/C23H18O6S2/c1-4-28-22(26)18-11(3)13-16(24)15-14(12-9-7-6-8-10-12)21(23(27)29-5-2)31-20(15)17(25)19(13)30-18/h6-10H,4-5H2,1-3H3