S-[3-azanyl-5-(dimethylcarbamoylsulfanyl)phenyl] N,N-dimethylcarbamothioate

Systemtic Name: S-[3-azanyl-5-(dimethylcarbamoylsulfanyl)phenyl] N,N-dimethylcarbamothioate Openeye Name: S-[3-amino-5-(dimethylcarbamoylsulfanyl)phenyl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[3-amino-5-[[dimethylamino(oxo)methyl]thio]phenyl] ester IUPAC Name: S-[3-amino-5-(dimethylcarbamoylsulfanyl)phenyl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[3-amino-5-(dimethylcarbamoylthio)phenyl] ester Formula: C12H17N3O2S2 MolecularWeight: 299.41228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC1=CC(=CC(=C1)N)SC(=O)N(C)C

Isomeric SMILES

CN(C)C(=O)SC1=CC(=CC(=C1)N)SC(=O)N(C)C

InChI

InChI=1S/C12H17N3O2S2/c1-14(2)11(16)18-9-5-8(13)6-10(7-9)19-12(17)15(3)4/h5-7H,13H2,1-4H3