(3S)-3-methyl-4-phenylsulfanyl-butanenitrile

Systemtic Name: (3S)-3-methyl-4-phenylsulfanyl-butanenitrile Openeye Name: (3S)-3-methyl-4-phenylsulfanyl-butanenitrile CAS Name: (3S)-3-methyl-4-(phenylthio)butanenitrile IUPAC Name: (3S)-3-methyl-4-phenylsulfanylbutanenitrile Traditional Name: (3S)-3-methyl-4-(phenylthio)butyronitrile Formula: C11H13NS MolecularWeight: 191.29262

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)CSC1=CC=CC=C1

Isomeric SMILES

C[C@@H](CC#N)CSC1=CC=CC=C1

InChI

InChI=1S/C11H13NS/c1-10(7-8-12)9-13-11-5-3-2-4-6-11/h2-6,10H,7,9H2,1H3/t10-/m0/s1