4-[1-[2-(chloranylamino)-3-methyl-butyl]sulfonylethyl]benzenecarbonitrile

Systemtic Name: 4-[1-[2-(chloranylamino)-3-methyl-butyl]sulfonylethyl]benzenecarbonitrile Openeye Name: 4-[1-[2-(chloroamino)-3-methyl-butyl]sulfonylethyl]benzonitrile CAS Name: 4-[1-[2-(chloroamino)-3-methylbutyl]sulfonylethyl]benzonitrile IUPAC Name: 4-[1-[2-(chloroamino)-3-methylbutyl]sulfonylethyl]benzonitrile Traditional Name: 4-[1-[2-(chloroamino)-3-methyl-butyl]sulfonylethyl]benzonitrile Formula: C14H19ClN2O2S MolecularWeight: 314.83086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CS(=O)(=O)C(C)C1=CC=C(C=C1)C#N)NCl

Isomeric SMILES

CC(C)C(CS(=O)(=O)C(C)C1=CC=C(C=C1)C#N)NCl

InChI

InChI=1S/C14H19ClN2O2S/c1-10(2)14(17-15)9-20(18,19)11(3)13-6-4-12(8-16)5-7-13/h4-7,10-11,14,17H,9H2,1-3H3