2-(2-methylphenoxy)ethyl N'-(4-chlorophenyl)carbamimidothioate

Systemtic Name: 2-(2-methylphenoxy)ethyl N'-(4-chlorophenyl)carbamimidothioate Openeye Name: 3-(4-chlorophenyl)-2-[2-(2-methylphenoxy)ethyl]isothiourea CAS Name: N'-(4-chlorophenyl)carbamimidothioic acid 2-(2-methylphenoxy)ethyl ester IUPAC Name: 2-(2-methylphenoxy)ethyl N'-(4-chlorophenyl)carbamimidothioate Traditional Name: 3-(4-chlorophenyl)-2-[2-(2-methylphenoxy)ethyl]isothiourea Formula: C16H17ClN2OS MolecularWeight: 320.83698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCSC(=NC2=CC=C(C=C2)Cl)N

Isomeric SMILES

CC1=CC=CC=C1OCCSC(=NC2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C16H17ClN2OS/c1-12-4-2-3-5-15(12)20-10-11-21-16(18)19-14-8-6-13(17)7-9-14/h2-9H,10-11H2,1H3,(H2,18,19)