1-(3,3-dimethylbut-1-ynylsulfanylsulfonyl)-4-methyl-benzene

Systemtic Name: 1-(3,3-dimethylbut-1-ynylsulfanylsulfonyl)-4-methyl-benzene Openeye Name: 1-(3,3-dimethylbut-1-ynylsulfanylsulfonyl)-4-methyl-benzene CAS Name: 1-(3,3-dimethylbut-1-ynylthio)sulfonyl-4-methylbenzene IUPAC Name: 1-(3,3-dimethylbut-1-ynylsulfanylsulfonyl)-4-methylbenzene Traditional Name: 1-(3,3-dimethylbut-1-ynylthio)sulfonyl-4-methyl-benzene Formula: C13H16O2S2 MolecularWeight: 268.39494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)SC#CC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)SC#CC(C)(C)C

InChI

InChI=1S/C13H16O2S2/c1-11-5-7-12(8-6-11)17(14,15)16-10-9-13(2,3)4/h5-8H,1-4H3