S-[2-(1,3-benzodithiol-2-ylidene)-5-(phenylcarbonylsulfanyl)-1,3-dithiol-4-yl] benzenecarbothioate

Systemtic Name: S-[2-(1,3-benzodithiol-2-ylidene)-5-(phenylcarbonylsulfanyl)-1,3-dithiol-4-yl] benzenecarbothioate Openeye Name: S-[2-(1,3-benzodithiol-2-ylidene)-5-benzoylsulfanyl-1,3-dithiol-4-yl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-(1,3-benzodithiol-2-ylidene)-5-(benzoylthio)-1,3-dithiol-4-yl] ester IUPAC Name: S-[2-(1,3-benzodithiol-2-ylidene)-5-benzoylsulfanyl-1,3-dithiol-4-yl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-(1,3-benzodithiol-2-ylidene)-5-(benzoylthio)-1,3-dithiol-4-yl] ester Formula: C24H14O2S6 MolecularWeight: 526.75676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC2=C(SC(=C3SC4=CC=CC=C4S3)S2)SC(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC2=C(SC(=C3SC4=CC=CC=C4S3)S2)SC(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H14O2S6/c25-19(15-9-3-1-4-10-15)29-22-23(30-20(26)16-11-5-2-6-12-16)32-24(31-22)21-27-17-13-7-8-14-18(17)28-21/h1-14H