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

Systemtic Name: ethyl N-[(4-fluorophenyl)methyl]-N-[(4-methoxyphenyl)methyl]-N'-methyl-carbamimidothioate Openeye Name: 2-ethyl-1-[(4-fluorophenyl)methyl]-1-[(4-methoxyphenyl)methyl]-3-methyl-isothiourea CAS Name: N-[(4-fluorophenyl)methyl]-N-[(4-methoxyphenyl)methyl]-N'-methylcarbamimidothioic acid ethyl ester IUPAC Name: ethyl N-[(4-fluorophenyl)methyl]-N-[(4-methoxyphenyl)methyl]-N'-methylcarbamimidothioate Traditional Name: 2-ethyl-1-(4-fluorobenzyl)-3-methyl-1-p-anisyl-isothiourea Formula: C19H23FN2OS MolecularWeight: 346.462123

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC)N(CC1=CC=C(C=C1)OC)CC2=CC=C(C=C2)F

Isomeric SMILES

CCSC(=NC)N(CC1=CC=C(C=C1)OC)CC2=CC=C(C=C2)F

InChI

InChI=1S/C19H23FN2OS/c1-4-24-19(21-2)22(13-15-5-9-17(20)10-6-15)14-16-7-11-18(23-3)12-8-16/h5-12H,4,13-14H2,1-3H3