N-[4-(2-cyanopropan-2-yl)phenyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanamide

Systemtic Name: N-[4-(2-cyanopropan-2-yl)phenyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanamide Openeye Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetamide CAS Name: N-[4-(2-cyanopropan-2-yl)phenyl]-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]acetamide IUPAC Name: N-[4-(2-cyanopropan-2-yl)phenyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetamide Traditional Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)NC2=CC=C(C=C2)C(C)(C)C#N

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)NC2=CC=C(C=C2)C(C)(C)C#N

InChI

InChI=1S/C18H21N3O2S/c1-12-16(13(2)23-21-12)9-24-10-17(22)20-15-7-5-14(6-8-15)18(3,4)11-19/h5-8H,9-10H2,1-4H3,(H,20,22)