2-methyl-2-oxidanyl-4-phenylsulfanyl-butanenitrile

Systemtic Name: 2-methyl-2-oxidanyl-4-phenylsulfanyl-butanenitrile Openeye Name: 2-hydroxy-2-methyl-4-phenylsulfanyl-butanenitrile CAS Name: 2-hydroxy-2-methyl-4-(phenylthio)butanenitrile IUPAC Name: 2-hydroxy-2-methyl-4-phenylsulfanylbutanenitrile Traditional Name: 2-hydroxy-2-methyl-4-(phenylthio)butyronitrile Formula: C11H13NOS MolecularWeight: 207.29202

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCSC1=CC=CC=C1)(C#N)O

Isomeric SMILES

CC(CCSC1=CC=CC=C1)(C#N)O

InChI

InChI=1S/C11H13NOS/c1-11(13,9-12)7-8-14-10-5-3-2-4-6-10/h2-6,13H,7-8H2,1H3