(3-azanyl-3-oxidanylidene-propyl) N-(1-ethylbenzimidazol-2-yl)carbamodithioate

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl) N-(1-ethylbenzimidazol-2-yl)carbamodithioate Openeye Name: (3-amino-3-oxo-propyl) N-(1-ethylbenzimidazol-2-yl)carbamodithioate CAS Name: N-(1-ethyl-2-benzimidazolyl)carbamodithioic acid (3-amino-3-oxopropyl) ester IUPAC Name: (3-amino-3-oxopropyl) N-(1-ethylbenzimidazol-2-yl)carbamodithioate Traditional Name: N-(1-ethylbenzimidazol-2-yl)carbamodithioic acid (3-amino-3-keto-propyl) ester Formula: C13H16N4OS2 MolecularWeight: 308.42234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1NC(=S)SCCC(=O)N

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1NC(=S)SCCC(=O)N

InChI

InChI=1S/C13H16N4OS2/c1-2-17-10-6-4-3-5-9(10)15-12(17)16-13(19)20-8-7-11(14)18/h3-6H,2,7-8H2,1H3,(H2,14,18)(H,15,16,19)