methyl N'-(2-fluorophenyl)-N-(4-methoxyphenyl)carbamimidothioate

Systemtic Name: methyl N'-(2-fluorophenyl)-N-(4-methoxyphenyl)carbamimidothioate Openeye Name: 3-(2-fluorophenyl)-1-(4-methoxyphenyl)-2-methyl-isothiourea CAS Name: N'-(2-fluorophenyl)-N-(4-methoxyphenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2-fluorophenyl)-N-(4-methoxyphenyl)carbamimidothioate Traditional Name: 3-(2-fluorophenyl)-1-(4-methoxyphenyl)-2-methyl-isothiourea Formula: C15H15FN2OS MolecularWeight: 290.355803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=NC2=CC=CC=C2F)SC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=NC2=CC=CC=C2F)SC

InChI

InChI=1S/C15H15FN2OS/c1-19-12-9-7-11(8-10-12)17-15(20-2)18-14-6-4-3-5-13(14)16/h3-10H,1-2H3,(H,17,18)