bis(4-fluorophenyl)methyl N'-[(2-methoxyphenyl)methyl]carbamimidothioate

Systemtic Name: bis(4-fluorophenyl)methyl N'-[(2-methoxyphenyl)methyl]carbamimidothioate Openeye Name: 2-[bis(4-fluorophenyl)methyl]-3-[(2-methoxyphenyl)methyl]isothiourea CAS Name: N'-[(2-methoxyphenyl)methyl]carbamimidothioic acid bis(4-fluorophenyl)methyl ester IUPAC Name: bis(4-fluorophenyl)methyl N'-[(2-methoxyphenyl)methyl]carbamimidothioate Traditional Name: 2-[bis(4-fluorophenyl)methyl]-3-o-anisyl-isothiourea Formula: C22H20F2N2OS MolecularWeight: 398.468806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN=C(N)SC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC=C1CN=C(N)SC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H20F2N2OS/c1-27-20-5-3-2-4-17(20)14-26-22(25)28-21(15-6-10-18(23)11-7-15)16-8-12-19(24)13-9-16/h2-13,21H,14H2,1H3,(H2,25,26)