N-(1-cyanocyclohexyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(1-cyanocyclohexyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-propanamide CAS Name: N-(1-cyanocyclohexyl)-2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: N-(1-cyanocyclohexyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylpropanamide Traditional Name: N-(1-cyanocyclohexyl)-2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]propionamide Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)SC2=NC3=CC=CC=C3N2CCOC

Isomeric SMILES

CC(C(=O)NC1(CCCCC1)C#N)SC2=NC3=CC=CC=C3N2CCOC

InChI

InChI=1S/C20H26N4O2S/c1-15(18(25)23-20(14-21)10-6-3-7-11-20)27-19-22-16-8-4-5-9-17(16)24(19)12-13-26-2/h4-5,8-9,15H,3,6-7,10-13H2,1-2H3,(H,23,25)