N-(1-cyanocyclohexyl)-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]propanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]propanamide Openeye Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide CAS Name: N-(1-cyanocyclohexyl)-2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]propanamide IUPAC Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(1-cyanocyclohexyl)propanamide Traditional Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]-N-(1-cyanocyclohexyl)propionamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SC(C)C(=O)NC2(CCCCC2)C#N)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(N1)SC(C)C(=O)NC2(CCCCC2)C#N)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4OS/c1-15-18(13-17-9-5-3-6-10-17)24-20(23-15)27-16(2)19(26)25-21(14-22)11-7-4-8-12-21/h3,5-6,9-10,16H,4,7-8,11-13H2,1-2H3,(H,23,24)(H,25,26)