4-[2-(chloromethylsulfanyl)propan-2-yl]benzenecarbonitrile

Systemtic Name: 4-[2-(chloromethylsulfanyl)propan-2-yl]benzenecarbonitrile Openeye Name: 4-[1-(chloromethylsulfanyl)-1-methyl-ethyl]benzonitrile CAS Name: 4-[2-(chloromethylthio)propan-2-yl]benzonitrile IUPAC Name: 4-[2-(chloromethylsulfanyl)propan-2-yl]benzonitrile Traditional Name: 4-[1-(chloromethylthio)-1-methyl-ethyl]benzonitrile Formula: C11H12ClNS MolecularWeight: 225.73768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C#N)SCCl

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C#N)SCCl

InChI

InChI=1S/C11H12ClNS/c1-11(2,14-8-12)10-5-3-9(7-13)4-6-10/h3-6H,8H2,1-2H3