(2S)-2-[(3-cyanophenyl)methylsulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[(3-cyanophenyl)methylsulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-ethanamide Openeye Name: (2S)-2-[(3-cyanophenyl)methylsulfanyl]-N-(5-methylisoxazol-3-yl)-2-phenyl-acetamide CAS Name: (2S)-2-[(3-cyanophenyl)methylthio]-N-(5-methyl-3-isoxazolyl)-2-phenylacetamide IUPAC Name: (2S)-2-[(3-cyanophenyl)methylsulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide Traditional Name: (2S)-2-[(3-cyanobenzyl)thio]-N-(5-methylisoxazol-3-yl)-2-phenyl-acetamide Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)SCC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C2=CC=CC=C2)SCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H17N3O2S/c1-14-10-18(23-25-14)22-20(24)19(17-8-3-2-4-9-17)26-13-16-7-5-6-15(11-16)12-21/h2-11,19H,13H2,1H3,(H,22,23,24)/t19-/m0/s1