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

Systemtic Name: S-[5-(phenylcarbonylsulfanyl)-2-(1,2,3-thiadiazol-5-ylmethylidene)-1,3-dithiol-4-yl] benzenecarbothioate Openeye Name: S-[5-benzoylsulfanyl-2-(thiadiazol-5-ylmethylene)-1,3-dithiol-4-yl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[5-(benzoylthio)-2-(5-thiadiazolylmethylidene)-1,3-dithiol-4-yl] ester IUPAC Name: S-[5-benzoylsulfanyl-2-(thiadiazol-5-ylmethylidene)-1,3-dithiol-4-yl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[5-(benzoylthio)-2-(thiadiazol-5-ylmethylene)-1,3-dithiol-4-yl] ester Formula: C20H12N2O2S5 MolecularWeight: 472.64648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC2=C(SC(=CC3=CN=NS3)S2)SC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC2=C(SC(=CC3=CN=NS3)S2)SC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H12N2O2S5/c23-17(13-7-3-1-4-8-13)27-19-20(28-18(24)14-9-5-2-6-10-14)26-16(25-19)11-15-12-21-22-29-15/h1-12H