S-(phenylmethyl) N-[2-(phenylmethylsulfanyl)phenyl]carbonylcarbamothioate

Systemtic Name: S-(phenylmethyl) N-[2-(phenylmethylsulfanyl)phenyl]carbonylcarbamothioate Openeye Name: S-benzyl N-(2-benzylsulfanylbenzoyl)carbamothioate CAS Name: N-[oxo-[2-(phenylmethylthio)phenyl]methyl]carbamothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl N-(2-benzylsulfanylbenzoyl)carbamothioate Traditional Name: N-[2-(benzylthio)benzoyl]thiocarbamic acid S-benzyl ester Formula: C22H19NO2S2 MolecularWeight: 393.52176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=CC=C2C(=O)NC(=O)SCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=CC=C2C(=O)NC(=O)SCC3=CC=CC=C3

InChI

InChI=1S/C22H19NO2S2/c24-21(23-22(25)27-16-18-11-5-2-6-12-18)19-13-7-8-14-20(19)26-15-17-9-3-1-4-10-17/h1-14H,15-16H2,(H,23,24,25)