S-[2-oxidanylidene-2-[2-[2-(phenylcarbonylsulfanyl)ethanoylamino]ethylamino]ethyl] benzenecarbothioate

Systemtic Name: S-[2-oxidanylidene-2-[2-[2-(phenylcarbonylsulfanyl)ethanoylamino]ethylamino]ethyl] benzenecarbothioate Openeye Name: S-[2-[2-[(2-benzoylsulfanylacetyl)amino]ethylamino]-2-oxo-ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[2-[[2-(benzoylthio)-1-oxoethyl]amino]ethylamino]-2-oxoethyl] ester IUPAC Name: S-[2-[2-[(2-benzoylsulfanylacetyl)amino]ethylamino]-2-oxoethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[2-[[2-(benzoylthio)acetyl]amino]ethylamino]-2-keto-ethyl] ester Formula: C20H20N2O4S2 MolecularWeight: 416.5138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCC(=O)NCCNC(=O)CSC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SCC(=O)NCCNC(=O)CSC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H20N2O4S2/c23-17(13-27-19(25)15-7-3-1-4-8-15)21-11-12-22-18(24)14-28-20(26)16-9-5-2-6-10-16/h1-10H,11-14H2,(H,21,23)(H,22,24)