S-[4-(phenylcarbamoyl)-3-(phenylcarbonylsulfanyl)-1,2-thiazol-5-yl] benzenecarbothioate

Systemtic Name: S-[4-(phenylcarbamoyl)-3-(phenylcarbonylsulfanyl)-1,2-thiazol-5-yl] benzenecarbothioate Openeye Name: S-[3-benzoylsulfanyl-4-(phenylcarbamoyl)isothiazol-5-yl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[4-[anilino(oxo)methyl]-3-(benzoylthio)-5-isothiazolyl] ester IUPAC Name: S-[3-benzoylsulfanyl-4-(phenylcarbamoyl)-1,2-thiazol-5-yl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[3-(benzoylthio)-4-(phenylcarbamoyl)isothiazol-5-yl] ester Formula: C24H16N2O3S3 MolecularWeight: 476.59044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC2=C(C(=NS2)SC(=O)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC2=C(C(=NS2)SC(=O)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H16N2O3S3/c27-20(25-18-14-8-3-9-15-18)19-21(30-22(28)16-10-4-1-5-11-16)26-32-24(19)31-23(29)17-12-6-2-7-13-17/h1-15H,(H,25,27)