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

Systemtic Name: methyl N'-(4-fluorophenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate Openeye Name: 3-(4-fluorophenyl)-1,1-bis[(4-methoxyphenyl)methyl]-2-methyl-isothiourea CAS Name: N'-(4-fluorophenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(4-fluorophenyl)-N,N-bis[(4-methoxyphenyl)methyl]carbamimidothioate Traditional Name: 3-(4-fluorophenyl)-2-methyl-1,1-bis(p-anisyl)isothiourea Formula: C24H25FN2O2S MolecularWeight: 424.530903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)OC)C(=NC3=CC=C(C=C3)F)SC

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC=C(C=C2)OC)C(=NC3=CC=C(C=C3)F)SC

InChI

InChI=1S/C24H25FN2O2S/c1-28-22-12-4-18(5-13-22)16-27(17-19-6-14-23(29-2)15-7-19)24(30-3)26-21-10-8-20(25)9-11-21/h4-15H,16-17H2,1-3H3