2-(5,6-dimethoxy-2-pyridin-4-yl-benzimidazol-1-yl)ethanethioamide

Systemtic Name: 2-(5,6-dimethoxy-2-pyridin-4-yl-benzimidazol-1-yl)ethanethioamide Openeye Name: 2-[5,6-dimethoxy-2-(4-pyridyl)benzimidazol-1-yl]thioacetamide CAS Name: 2-(5,6-dimethoxy-2-pyridin-4-yl-1-benzimidazolyl)ethanethioamide IUPAC Name: 2-(5,6-dimethoxy-2-pyridin-4-ylbenzimidazol-1-yl)ethanethioamide Traditional Name: 2-[5,6-dimethoxy-2-(4-pyridyl)benzimidazol-1-yl]thioacetamide Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N2CC(=S)N)C3=CC=NC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N2CC(=S)N)C3=CC=NC=C3)OC

InChI

InChI=1S/C16H16N4O2S/c1-21-13-7-11-12(8-14(13)22-2)20(9-15(17)23)16(19-11)10-3-5-18-6-4-10/h3-8H,9H2,1-2H3,(H2,17,23)