2-[4-(4,4-dimethylpentan-2-yl)phenyl]-1-benzothiophene

Systemtic Name: 2-[4-(4,4-dimethylpentan-2-yl)phenyl]-1-benzothiophene Openeye Name: 2-[4-(1,3,3-trimethylbutyl)phenyl]benzothiophene CAS Name: 2-[4-(4,4-dimethylpentan-2-yl)phenyl]-1-benzothiophene IUPAC Name: 2-[4-(4,4-dimethylpentan-2-yl)phenyl]-1-benzothiophene Traditional Name: 2-[4-(1,3,3-trimethylbutyl)phenyl]benzothiophene Formula: C21H24S MolecularWeight: 308.48026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)C)C1=CC=C(C=C1)C2=CC3=CC=CC=C3S2

Isomeric SMILES

CC(CC(C)(C)C)C1=CC=C(C=C1)C2=CC3=CC=CC=C3S2

InChI

InChI=1S/C21H24S/c1-15(14-21(2,3)4)16-9-11-17(12-10-16)20-13-18-7-5-6-8-19(18)22-20/h5-13,15H,14H2,1-4H3