3-(2,4,4-trimethylpentan-2-yl)benzenethiol

Systemtic Name: 3-(2,4,4-trimethylpentan-2-yl)benzenethiol Openeye Name: 3-(1,1,3,3-tetramethylbutyl)benzenethiol CAS Name: 3-(2,4,4-trimethylpentan-2-yl)benzenethiol IUPAC Name: 3-(2,4,4-trimethylpentan-2-yl)benzenethiol Traditional Name: 3-(1,1,3,3-tetramethylbutyl)benzenethiol Formula: C14H22S MolecularWeight: 222.38948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22S/c1-13(2,3)10-14(4,5)11-7-6-8-12(15)9-11/h6-9,15H,10H2,1-5H3