N-(2-chloranylpyridin-3-yl)-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-3-pyridyl)-2-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-3-pyridyl)-2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]acetamide Formula: C21H24ClN5O3S2 MolecularWeight: 494.02996

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)NC4=C(N=CC=C4)Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC(=O)NC4=C(N=CC=C4)Cl

InChI

InChI=1S/C21H24ClN5O3S2/c1-2-27-18-9-8-15(32(29,30)26-11-4-3-5-12-26)13-17(18)25-21(27)31-14-19(28)24-16-7-6-10-23-20(16)22/h6-10,13H,2-5,11-12,14H2,1H3,(H,24,28)