(2S)-2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-cyclopentyl-propanamide

Systemtic Name: (2S)-2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-cyclopentyl-propanamide Openeye Name: (2S)-2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-cyclopentyl-propanamide CAS Name: (2S)-2-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-cyclopentylpropanamide IUPAC Name: (2S)-2-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-cyclopentylpropanamide Traditional Name: (2S)-2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]thio]-N-cyclopentyl-propionamide Formula: C19H18F3N3OS2 MolecularWeight: 425.49093

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N

Isomeric SMILES

C[C@@H](C(=O)NC1CCCC1)SC2=C(C(=CC(=N2)C3=CC=CS3)C(F)(F)F)C#N

InChI

InChI=1S/C19H18F3N3OS2/c1-11(17(26)24-12-5-2-3-6-12)28-18-13(10-23)14(19(20,21)22)9-15(25-18)16-7-4-8-27-16/h4,7-9,11-12H,2-3,5-6H2,1H3,(H,24,26)/t11-/m0/s1