2-tert-butyl-4-phenyl-benzenethiol

Systemtic Name: 2-tert-butyl-4-phenyl-benzenethiol Openeye Name: 2-tert-butyl-4-phenyl-benzenethiol CAS Name: 2-tert-butyl-4-phenylbenzenethiol IUPAC Name: 2-tert-butyl-4-phenylbenzenethiol Traditional Name: 2-tert-butyl-4-phenyl-benzenethiol Formula: C16H18S MolecularWeight: 242.37912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C2=CC=CC=C2)S

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C2=CC=CC=C2)S

InChI

InChI=1S/C16H18S/c1-16(2,3)14-11-13(9-10-15(14)17)12-7-5-4-6-8-12/h4-11,17H,1-3H3