dimethyl 2-(3-oxidanylidene-2-benzothiophen-1-ylidene)-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(3-oxidanylidene-2-benzothiophen-1-ylidene)-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-(3-oxo-2-benzothiophen-1-ylidene)-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-(3-oxo-2-benzothiophen-1-ylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(3-oxo-2-benzothiophen-1-ylidene)-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-(3-ketoisobenzothiophen-1-ylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C15H10O5S3 MolecularWeight: 366.4319

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C2C3=CC=CC=C3C(=O)S2)S1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC(=C2C3=CC=CC=C3C(=O)S2)S1)C(=O)OC

InChI

InChI=1S/C15H10O5S3/c1-19-12(16)10-11(13(17)20-2)23-15(22-10)9-7-5-3-4-6-8(7)14(18)21-9/h3-6H,1-2H3