S-[2-(phenylcarbonylsulfanylcarbothioylamino)ethylcarbamothioyl] benzenecarbothioate

Systemtic Name: S-[2-(phenylcarbonylsulfanylcarbothioylamino)ethylcarbamothioyl] benzenecarbothioate Openeye Name: S-[2-(benzoylsulfanylcarbothioylamino)ethylcarbamothioyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[[2-[[(benzoylthio)-sulfanylidenemethyl]amino]ethylamino]-sulfanylidenemethyl] ester IUPAC Name: S-[2-(benzoylsulfanylcarbothioylamino)ethylcarbamothioyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[(benzoylthio)carbothioylamino]ethylthiocarbamoyl] ester Formula: C18H16N2O2S4 MolecularWeight: 420.59184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC(=S)NCCNC(=S)SC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC(=S)NCCNC(=S)SC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H16N2O2S4/c21-15(13-7-3-1-4-8-13)25-17(23)19-11-12-20-18(24)26-16(22)14-9-5-2-6-10-14/h1-10H,11-12H2,(H,19,23)(H,20,24)