1-(2,5-dimethylthiophen-3-yl)-3,3-dimethyl-butan-1-one

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)-3,3-dimethyl-butan-1-one Openeye Name: 1-(2,5-dimethyl-3-thienyl)-3,3-dimethyl-butan-1-one CAS Name: 1-(2,5-dimethyl-3-thiophenyl)-3,3-dimethyl-1-butanone IUPAC Name: 1-(2,5-dimethylthiophen-3-yl)-3,3-dimethylbutan-1-one Traditional Name: 1-(2,5-dimethyl-3-thienyl)-3,3-dimethyl-butan-1-one Formula: C12H18OS MolecularWeight: 210.33572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CC(C)(C)C

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CC(C)(C)C

InChI

InChI=1S/C12H18OS/c1-8-6-10(9(2)14-8)11(13)7-12(3,4)5/h6H,7H2,1-5H3