S-[tris(4-fluorophenyl)methyl] N-methylcarbamothioate

Systemtic Name: S-[tris(4-fluorophenyl)methyl] N-methylcarbamothioate Openeye Name: S-[tris(4-fluorophenyl)methyl] N-methylcarbamothioate CAS Name: N-methylcarbamothioic acid S-[tris(4-fluorophenyl)methyl] ester IUPAC Name: S-[tris(4-fluorophenyl)methyl] N-methylcarbamothioate Traditional Name: N-methylthiocarbamic acid S-[tris(4-fluorophenyl)methyl] ester Formula: C21H16F3NOS MolecularWeight: 387.41805

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)SC(C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

Isomeric SMILES

CNC(=O)SC(C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H16F3NOS/c1-25-20(26)27-21(14-2-8-17(22)9-3-14,15-4-10-18(23)11-5-15)16-6-12-19(24)13-7-16/h2-13H,1H3,(H,25,26)