4-(5,6-dimethylbenzimidazol-1-yl)butanethioamide

Systemtic Name: 4-(5,6-dimethylbenzimidazol-1-yl)butanethioamide Openeye Name: 4-(5,6-dimethylbenzimidazol-1-yl)butanethioamide CAS Name: 4-(5,6-dimethyl-1-benzimidazolyl)butanethioamide IUPAC Name: 4-(5,6-dimethylbenzimidazol-1-yl)butanethioamide Traditional Name: 4-(5,6-dimethylbenzimidazol-1-yl)thiobutyramide Formula: C13H17N3S MolecularWeight: 247.35918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)CCCC(=S)N

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)CCCC(=S)N

InChI

InChI=1S/C13H17N3S/c1-9-6-11-12(7-10(9)2)16(8-15-11)5-3-4-13(14)17/h6-8H,3-5H2,1-2H3,(H2,14,17)