2-(4-fluoranylphenoxy)ethyl N'-(2,5-dimethylphenyl)carbamimidothioate

Systemtic Name: 2-(4-fluoranylphenoxy)ethyl N'-(2,5-dimethylphenyl)carbamimidothioate Openeye Name: 3-(2,5-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethyl]isothiourea CAS Name: N'-(2,5-dimethylphenyl)carbamimidothioic acid 2-(4-fluorophenoxy)ethyl ester IUPAC Name: 2-(4-fluorophenoxy)ethyl N'-(2,5-dimethylphenyl)carbamimidothioate Traditional Name: 3-(2,5-dimethylphenyl)-2-[2-(4-fluorophenoxy)ethyl]isothiourea Formula: C17H19FN2OS MolecularWeight: 318.408963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N=C(N)SCCOC2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)N=C(N)SCCOC2=CC=C(C=C2)F

InChI

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