5-bromanyl-2-(2-propan-2-ylphenyl)sulfanyl-benzenecarbonitrile

Systemtic Name: 5-bromanyl-2-(2-propan-2-ylphenyl)sulfanyl-benzenecarbonitrile Openeye Name: 5-bromo-2-(2-isopropylphenyl)sulfanyl-benzonitrile CAS Name: 5-bromo-2-[(2-propan-2-ylphenyl)thio]benzonitrile IUPAC Name: 5-bromo-2-(2-propan-2-ylphenyl)sulfanylbenzonitrile Traditional Name: 5-bromo-2-(o-cumenylthio)benzonitrile Formula: C16H14BrNS MolecularWeight: 332.25806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(C=C(C=C2)Br)C#N

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(C=C(C=C2)Br)C#N

InChI

InChI=1S/C16H14BrNS/c1-11(2)14-5-3-4-6-16(14)19-15-8-7-13(17)9-12(15)10-18/h3-9,11H,1-2H3