(2R)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(1-cyanocyclohexyl)-N-methyl-propanamide

Systemtic Name: (2R)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(1-cyanocyclohexyl)-N-methyl-propanamide Openeye Name: (2R)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(1-cyanocyclohexyl)-N-methyl-propanamide CAS Name: (2R)-2-(1H-benzimidazol-2-ylthio)-N-(1-cyanocyclohexyl)-N-methylpropanamide IUPAC Name: (2R)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(1-cyanocyclohexyl)-N-methylpropanamide Traditional Name: (2R)-2-(1H-benzimidazol-2-ylthio)-N-(1-cyanocyclohexyl)-N-methyl-propionamide Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1(CCCCC1)C#N)SC2=NC3=CC=CC=C3N2

Isomeric SMILES

C[C@H](C(=O)N(C)C1(CCCCC1)C#N)SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H22N4OS/c1-13(24-17-20-14-8-4-5-9-15(14)21-17)16(23)22(2)18(12-19)10-6-3-7-11-18/h4-5,8-9,13H,3,6-7,10-11H2,1-2H3,(H,20,21)/t13-/m1/s1