4-[(2S)-butan-2-yl]sulfanylbenzenecarbonitrile

Systemtic Name: 4-[(2S)-butan-2-yl]sulfanylbenzenecarbonitrile Openeye Name: 4-[(1S)-1-methylpropyl]sulfanylbenzonitrile CAS Name: 4-[[(2S)-butan-2-yl]thio]benzonitrile IUPAC Name: 4-[(2S)-butan-2-yl]sulfanylbenzonitrile Traditional Name: 4-[[(1S)-1-methylpropyl]thio]benzonitrile Formula: C11H13NS MolecularWeight: 191.29262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC=C(C=C1)C#N

Isomeric SMILES

CC[C@H](C)SC1=CC=C(C=C1)C#N

InChI

InChI=1S/C11H13NS/c1-3-9(2)13-11-6-4-10(8-12)5-7-11/h4-7,9H,3H2,1-2H3/t9-/m0/s1