N-(2-chloranylpyridin-3-yl)-2-(1-hexylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-(1-hexylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-3-pyridyl)-2-(1-hexylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-[(1-hexyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-(1-hexylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-3-pyridyl)-2-[(1-hexylbenzimidazol-2-yl)thio]acetamide Formula: C20H23ClN4OS MolecularWeight: 402.94082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC3=C(N=CC=C3)Cl

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1SCC(=O)NC3=C(N=CC=C3)Cl

InChI

InChI=1S/C20H23ClN4OS/c1-2-3-4-7-13-25-17-11-6-5-9-15(17)24-20(25)27-14-18(26)23-16-10-8-12-22-19(16)21/h5-6,8-12H,2-4,7,13-14H2,1H3,(H,23,26)