1-(6-methyl-1H-benzimidazol-2-yl)propan-2-yl carbamimidothioate

Systemtic Name: 1-(6-methyl-1H-benzimidazol-2-yl)propan-2-yl carbamimidothioate Openeye Name: 2-[1-methyl-2-(6-methyl-1H-benzimidazol-2-yl)ethyl]isothiourea CAS Name: carbamimidothioic acid 1-(6-methyl-1H-benzimidazol-2-yl)propan-2-yl ester IUPAC Name: 1-(6-methyl-1H-benzimidazol-2-yl)propan-2-yl carbamimidothioate Traditional Name: 2-[1-methyl-2-(6-methyl-1H-benzimidazol-2-yl)ethyl]isothiourea Formula: C12H16N4S MolecularWeight: 248.34724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)CC(C)SC(=N)N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)CC(C)SC(=N)N

InChI

InChI=1S/C12H16N4S/c1-7-3-4-9-10(5-7)16-11(15-9)6-8(2)17-12(13)14/h3-5,8H,6H2,1-2H3,(H3,13,14)(H,15,16)