(2S,3R)-3-[(R)-(4-methylphenyl)sulfinyl]-2-oxidanyl-2-phenyl-butanenitrile

Systemtic Name: (2S,3R)-3-[(R)-(4-methylphenyl)sulfinyl]-2-oxidanyl-2-phenyl-butanenitrile Openeye Name: (2S,3R)-2-hydroxy-2-phenyl-3-[(R)-p-tolylsulfinyl]butanenitrile CAS Name: (2S,3R)-2-hydroxy-3-[(R)-(4-methylphenyl)sulfinyl]-2-phenylbutanenitrile IUPAC Name: (2S,3R)-2-hydroxy-3-[(R)-(4-methylphenyl)sulfinyl]-2-phenylbutanenitrile Traditional Name: (2S,3R)-2-hydroxy-2-phenyl-3-[(R)-p-tolylsulfinyl]butyronitrile Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(C)C(C#N)(C2=CC=CC=C2)O

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)[C@H](C)[C@@](C#N)(C2=CC=CC=C2)O

InChI

InChI=1S/C17H17NO2S/c1-13-8-10-16(11-9-13)21(20)14(2)17(19,12-18)15-6-4-3-5-7-15/h3-11,14,19H,1-2H3/t14-,17+,21-/m1/s1