4,4-dimethyl-1-phenylsulfanyl-pent-1-yn-3-ol

Systemtic Name: 4,4-dimethyl-1-phenylsulfanyl-pent-1-yn-3-ol Openeye Name: 4,4-dimethyl-1-phenylsulfanyl-pent-1-yn-3-ol CAS Name: 4,4-dimethyl-1-(phenylthio)-1-pentyn-3-ol IUPAC Name: 4,4-dimethyl-1-phenylsulfanylpent-1-yn-3-ol Traditional Name: 4,4-dimethyl-1-(phenylthio)pent-1-yn-3-ol Formula: C13H16OS MolecularWeight: 220.33054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C#CSC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C)C(C#CSC1=CC=CC=C1)O

InChI

InChI=1S/C13H16OS/c1-13(2,3)12(14)9-10-15-11-7-5-4-6-8-11/h4-8,12,14H,1-3H3