2-(2-butylbenzimidazol-1-yl)ethanethioamide

Systemtic Name: 2-(2-butylbenzimidazol-1-yl)ethanethioamide Openeye Name: 2-(2-butylbenzimidazol-1-yl)thioacetamide CAS Name: 2-(2-butyl-1-benzimidazolyl)ethanethioamide IUPAC Name: 2-(2-butylbenzimidazol-1-yl)ethanethioamide Traditional Name: 2-(2-butylbenzimidazol-1-yl)thioacetamide Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC(=S)N

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC(=S)N

InChI

InChI=1S/C13H17N3S/c1-2-3-8-13-15-10-6-4-5-7-11(10)16(13)9-12(14)17/h4-7H,2-3,8-9H2,1H3,(H2,14,17)