2-[3-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-N-(3-ethoxypropyl)ethanamide

Systemtic Name: 2-[3-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-N-(3-ethoxypropyl)ethanamide Openeye Name: 2-[[3-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]-N-(3-ethoxypropyl)acetamide CAS Name: 2-[[3-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridinyl]thio]-N-(3-ethoxypropyl)acetamide IUPAC Name: 2-[3-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-N-(3-ethoxypropyl)acetamide Traditional Name: 2-[[3-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]thio]-N-(3-ethoxypropyl)acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)CSC1=C(C=CC=N1)C2=NC3=C(N2)C=C(C(=C3)C)C

Isomeric SMILES

CCOCCCNC(=O)CSC1=C(C=CC=N1)C2=NC3=C(N2)C=C(C(=C3)C)C

InChI

InChI=1S/C21H26N4O2S/c1-4-27-10-6-9-22-19(26)13-28-21-16(7-5-8-23-21)20-24-17-11-14(2)15(3)12-18(17)25-20/h5,7-8,11-12H,4,6,9-10,13H2,1-3H3,(H,22,26)(H,24,25)