O-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5,6-dimethyl-pyrimidin-4-yl] N,N-dimethylcarbamothioate

Systemtic Name: O-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5,6-dimethyl-pyrimidin-4-yl] N,N-dimethylcarbamothioate Openeye Name: O-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-5,6-dimethyl-pyrimidin-4-yl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid O-[[2-[(2-chloro-6-fluorophenyl)methylthio]-5,6-dimethyl-4-pyrimidinyl]] ester IUPAC Name: O-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid O-[2-[(2-chloro-6-fluoro-benzyl)thio]-5,6-dimethyl-pyrimidin-4-yl] ester Formula: C16H17ClFN3OS2 MolecularWeight: 385.907083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1OC(=S)N(C)C)SCC2=C(C=CC=C2Cl)F)C

Isomeric SMILES

CC1=C(N=C(N=C1OC(=S)N(C)C)SCC2=C(C=CC=C2Cl)F)C

InChI

InChI=1S/C16H17ClFN3OS2/c1-9-10(2)19-15(20-14(9)22-16(23)21(3)4)24-8-11-12(17)6-5-7-13(11)18/h5-7H,8H2,1-4H3