3-(1-sulfanylbenzimidazol-2-yl)propyl carbamimidothioate

Systemtic Name: 3-(1-sulfanylbenzimidazol-2-yl)propyl carbamimidothioate Openeye Name: 2-[3-(1-sulfanylbenzimidazol-2-yl)propyl]isothiourea CAS Name: carbamimidothioic acid 3-(1-mercapto-2-benzimidazolyl)propyl ester IUPAC Name: 3-(1-sulfanylbenzimidazol-2-yl)propyl carbamimidothioate Traditional Name: 2-[3-(1-mercaptobenzimidazol-2-yl)propyl]isothiourea Formula: C11H14N4S2 MolecularWeight: 266.38566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2S)CCCSC(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2S)CCCSC(=N)N

InChI

InChI=1S/C11H14N4S2/c12-11(13)17-7-3-6-10-14-8-4-1-2-5-9(8)15(10)16/h1-2,4-5,16H,3,6-7H2,(H3,12,13)