(4-methoxypyridin-2-yl)methyl N'-[3-(trifluoromethyl)phenyl]carbamimidothioate

Systemtic Name: (4-methoxypyridin-2-yl)methyl N'-[3-(trifluoromethyl)phenyl]carbamimidothioate Openeye Name: 2-[(4-methoxy-2-pyridyl)methyl]-3-[3-(trifluoromethyl)phenyl]isothiourea CAS Name: N'-[3-(trifluoromethyl)phenyl]carbamimidothioic acid (4-methoxy-2-pyridinyl)methyl ester IUPAC Name: (4-methoxypyridin-2-yl)methyl N'-[3-(trifluoromethyl)phenyl]carbamimidothioate Traditional Name: 2-[(4-methoxy-2-pyridyl)methyl]-3-[3-(trifluoromethyl)phenyl]isothiourea Formula: C15H14F3N3OS MolecularWeight: 341.35137

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)CSC(=NC2=CC=CC(=C2)C(F)(F)F)N

Isomeric SMILES

COC1=CC(=NC=C1)CSC(=NC2=CC=CC(=C2)C(F)(F)F)N

InChI

InChI=1S/C15H14F3N3OS/c1-22-13-5-6-20-12(8-13)9-23-14(19)21-11-4-2-3-10(7-11)15(16,17)18/h2-8H,9H2,1H3,(H2,19,21)