2-tert-butyl-3,3-dimethyl-2H-1-benzothiophene-5-carbonitrile

Systemtic Name: 2-tert-butyl-3,3-dimethyl-2H-1-benzothiophene-5-carbonitrile Openeye Name: 2-tert-butyl-3,3-dimethyl-2H-benzothiophene-5-carbonitrile CAS Name: 2-tert-butyl-3,3-dimethyl-2H-1-benzothiophene-5-carbonitrile IUPAC Name: 2-tert-butyl-3,3-dimethyl-2H-1-benzothiophene-5-carbonitrile Traditional Name: 2-tert-butyl-3,3-dimethyl-2H-benzothiophene-5-carbonitrile Formula: C15H19NS MolecularWeight: 245.38306

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(SC2=C1C=C(C=C2)C#N)C(C)(C)C)C

Isomeric SMILES

CC1(C(SC2=C1C=C(C=C2)C#N)C(C)(C)C)C

InChI

InChI=1S/C15H19NS/c1-14(2,3)13-15(4,5)11-8-10(9-16)6-7-12(11)17-13/h6-8,13H,1-5H3