methyl N-ethyl-N-[(6-fluoranylpyridin-3-yl)methyl]-N'-methyl-carbamimidothioate

Systemtic Name: methyl N-ethyl-N-[(6-fluoranylpyridin-3-yl)methyl]-N'-methyl-carbamimidothioate Openeye Name: 1-ethyl-1-[(6-fluoro-3-pyridyl)methyl]-2,3-dimethyl-isothiourea CAS Name: N-ethyl-N-[(6-fluoro-3-pyridinyl)methyl]-N'-methylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-ethyl-N-[(6-fluoropyridin-3-yl)methyl]-N'-methylcarbamimidothioate Traditional Name: 1-ethyl-1-[(6-fluoro-3-pyridyl)methyl]-2,3-dimethyl-isothiourea Formula: C11H16FN3S MolecularWeight: 241.328243

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CN=C(C=C1)F)C(=NC)SC

Isomeric SMILES

CCN(CC1=CN=C(C=C1)F)C(=NC)SC

InChI

InChI=1S/C11H16FN3S/c1-4-15(11(13-2)16-3)8-9-5-6-10(12)14-7-9/h5-7H,4,8H2,1-3H3