(2R)-N-(1-cyanocyclohexyl)-2-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(1-cyanocyclohexyl)-2-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)sulfanyl]propanamide Openeye Name: (2R)-2-[[4,5-bis(2-thienyl)-1H-imidazol-2-yl]sulfanyl]-N-(1-cyanocyclohexyl)propanamide CAS Name: (2R)-N-(1-cyanocyclohexyl)-2-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)thio]propanamide IUPAC Name: (2R)-N-(1-cyanocyclohexyl)-2-[(4,5-dithiophen-2-yl-1H-imidazol-2-yl)sulfanyl]propanamide Traditional Name: (2R)-2-[[4,5-bis(2-thienyl)-1H-imidazol-2-yl]thio]-N-(1-cyanocyclohexyl)propionamide Formula: C21H22N4OS3 MolecularWeight: 442.62058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)SC2=NC(=C(N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

C[C@H](C(=O)NC1(CCCCC1)C#N)SC2=NC(=C(N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C21H22N4OS3/c1-14(19(26)25-21(13-22)9-3-2-4-10-21)29-20-23-17(15-7-5-11-27-15)18(24-20)16-8-6-12-28-16/h5-8,11-12,14H,2-4,9-10H2,1H3,(H,23,24)(H,25,26)/t14-/m1/s1