(2-bromophenyl)methyl N'-methylcarbamimidothioate

Systemtic Name: (2-bromophenyl)methyl N'-methylcarbamimidothioate Openeye Name: 2-[(2-bromophenyl)methyl]-3-methyl-isothiourea CAS Name: N'-methylcarbamimidothioic acid (2-bromophenyl)methyl ester IUPAC Name: (2-bromophenyl)methyl N'-methylcarbamimidothioate Traditional Name: 2-(2-bromobenzyl)-3-methyl-isothiourea Formula: C9H11BrN2S MolecularWeight: 259.16604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)SCC1=CC=CC=C1Br

Isomeric SMILES

CN=C(N)SCC1=CC=CC=C1Br

InChI

InChI=1S/C9H11BrN2S/c1-12-9(11)13-6-7-4-2-3-5-8(7)10/h2-5H,6H2,1H3,(H2,11,12)