S-methyl N-[2-[[4-(trifluoromethyl)pyridin-3-yl]carbonylamino]ethyl]carbamothioate

Systemtic Name: S-methyl N-[2-[[4-(trifluoromethyl)pyridin-3-yl]carbonylamino]ethyl]carbamothioate Openeye Name: S-methyl N-[2-[[4-(trifluoromethyl)pyridine-3-carbonyl]amino]ethyl]carbamothioate CAS Name: N-[2-[[oxo-[4-(trifluoromethyl)-3-pyridinyl]methyl]amino]ethyl]carbamothioic acid S-methyl ester IUPAC Name: S-methyl N-[2-[[4-(trifluoromethyl)pyridine-3-carbonyl]amino]ethyl]carbamothioate Traditional Name: N-[2-[[4-(trifluoromethyl)nicotinoyl]amino]ethyl]thiocarbamic acid S-methyl ester Formula: C11H12F3N3O2S MolecularWeight: 307.29209

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=O)NCCNC(=O)C1=C(C=CN=C1)C(F)(F)F

Isomeric SMILES

CSC(=O)NCCNC(=O)C1=C(C=CN=C1)C(F)(F)F

InChI

InChI=1S/C11H12F3N3O2S/c1-20-10(19)17-5-4-16-9(18)7-6-15-3-2-8(7)11(12,13)14/h2-3,6H,4-5H2,1H3,(H,16,18)(H,17,19)