2-(2-fluoranylphenoxy)ethyl N'-(3,4-dimethylphenyl)carbamimidothioate

Systemtic Name: 2-(2-fluoranylphenoxy)ethyl N'-(3,4-dimethylphenyl)carbamimidothioate Openeye Name: 3-(3,4-dimethylphenyl)-2-[2-(2-fluorophenoxy)ethyl]isothiourea CAS Name: N'-(3,4-dimethylphenyl)carbamimidothioic acid 2-(2-fluorophenoxy)ethyl ester IUPAC Name: 2-(2-fluorophenoxy)ethyl N'-(3,4-dimethylphenyl)carbamimidothioate Traditional Name: 3-(3,4-dimethylphenyl)-2-[2-(2-fluorophenoxy)ethyl]isothiourea Formula: C17H19FN2OS MolecularWeight: 318.408963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=C(N)SCCOC2=CC=CC=C2F)C

Isomeric SMILES

CC1=C(C=C(C=C1)N=C(N)SCCOC2=CC=CC=C2F)C

InChI

InChI=1S/C17H19FN2OS/c1-12-7-8-14(11-13(12)2)20-17(19)22-10-9-21-16-6-4-3-5-15(16)18/h3-8,11H,9-10H2,1-2H3,(H2,19,20)