2-(3-bromanylphenoxy)ethyl N'-(3-methylbutyl)carbamimidothioate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl N'-(3-methylbutyl)carbamimidothioate Openeye Name: 2-[2-(3-bromophenoxy)ethyl]-3-isopentyl-isothiourea CAS Name: N'-(3-methylbutyl)carbamimidothioic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl N'-(3-methylbutyl)carbamimidothioate Traditional Name: 2-[2-(3-bromophenoxy)ethyl]-3-isoamyl-isothiourea Formula: C14H21BrN2OS MolecularWeight: 345.29834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN=C(N)SCCOC1=CC(=CC=C1)Br

Isomeric SMILES

CC(C)CCN=C(N)SCCOC1=CC(=CC=C1)Br

InChI

InChI=1S/C14H21BrN2OS/c1-11(2)6-7-17-14(16)19-9-8-18-13-5-3-4-12(15)10-13/h3-5,10-11H,6-9H2,1-2H3,(H2,16,17)