2-(3-methylphenoxy)ethyl N'-prop-2-enylcarbamimidothioate

Systemtic Name: 2-(3-methylphenoxy)ethyl N'-prop-2-enylcarbamimidothioate Openeye Name: 3-allyl-2-[2-(3-methylphenoxy)ethyl]isothiourea CAS Name: N'-prop-2-enylcarbamimidothioic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl N'-prop-2-enylcarbamimidothioate Traditional Name: 3-allyl-2-[2-(3-methylphenoxy)ethyl]isothiourea Formula: C13H18N2OS MolecularWeight: 250.35982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC(=NCC=C)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC(=NCC=C)N

InChI

InChI=1S/C13H18N2OS/c1-3-7-15-13(14)17-9-8-16-12-6-4-5-11(2)10-12/h3-6,10H,1,7-9H2,2H3,(H2,14,15)