(3-fluoranyl-4-methoxy-phenyl)methyl N'-phenylcarbamimidothioate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl N'-phenylcarbamimidothioate Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methyl]-3-phenyl-isothiourea CAS Name: N'-phenylcarbamimidothioic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl N'-phenylcarbamimidothioate Traditional Name: 2-(3-fluoro-4-methoxy-benzyl)-3-phenyl-isothiourea Formula: C15H15FN2OS MolecularWeight: 290.355803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15FN2OS/c1-19-14-8-7-11(9-13(14)16)10-20-15(17)18-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H2,17,18)