(3-fluoranyl-4-methoxy-phenyl)methyl N,N'-dimethylcarbamimidothioate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl N,N'-dimethylcarbamimidothioate Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methyl]-1,3-dimethyl-isothiourea CAS Name: N,N'-dimethylcarbamimidothioic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl N,N'-dimethylcarbamimidothioate Traditional Name: 2-(3-fluoro-4-methoxy-benzyl)-1,3-dimethyl-isothiourea Formula: C11H15FN2OS MolecularWeight: 242.313003

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=NC)SCC1=CC(=C(C=C1)OC)F

Isomeric SMILES

CNC(=NC)SCC1=CC(=C(C=C1)OC)F

InChI

InChI=1S/C11H15FN2OS/c1-13-11(14-2)16-7-8-4-5-10(15-3)9(12)6-8/h4-6H,7H2,1-3H3,(H,13,14)