N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-[1-(3-methylbutyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-[1-(3-methylbutyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-(2-furylmethyl)-2-(1-isopentylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-N-(2-furanylmethyl)-2-[[1-(3-methylbutyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-[1-(3-methylbutyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-(2-furfuryl)-2-[(1-isoamylbenzimidazol-2-yl)thio]acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2N=C1SCC(=O)N(CCC#N)CC3=CC=CO3

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2N=C1SCC(=O)N(CCC#N)CC3=CC=CO3

InChI

InChI=1S/C22H26N4O2S/c1-17(2)10-13-26-20-9-4-3-8-19(20)24-22(26)29-16-21(27)25(12-6-11-23)15-18-7-5-14-28-18/h3-5,7-9,14,17H,6,10,12-13,15-16H2,1-2H3