N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]acetamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanylacetamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]acetamide Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NCCC2=NC3=CC=CC=C3N2)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NCCC2=NC3=CC=CC=C3N2)C

InChI

InChI=1S/C20H21N5OS/c1-12-13(2)15(10-21)20(23-14(12)3)27-11-19(26)22-9-8-18-24-16-6-4-5-7-17(16)25-18/h4-7H,8-9,11H2,1-3H3,(H,22,26)(H,24,25)