5-bromanyl-3-phenylsulfanyl-hex-5-enenitrile

Systemtic Name: 5-bromanyl-3-phenylsulfanyl-hex-5-enenitrile Openeye Name: 5-bromo-3-phenylsulfanyl-hex-5-enenitrile CAS Name: 5-bromo-3-(phenylthio)-5-hexenenitrile IUPAC Name: 5-bromo-3-phenylsulfanylhex-5-enenitrile Traditional Name: 5-bromo-3-(phenylthio)hex-5-enenitrile Formula: C12H12BrNS MolecularWeight: 282.19938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12BrNS/c1-10(13)9-12(7-8-14)15-11-5-3-2-4-6-11/h2-6,12H,1,7,9H2