2,3,6-trimethyl-1-(3-methylbutylsulfanyl)hept-6-en-4-yn-3-ol

Systemtic Name: 2,3,6-trimethyl-1-(3-methylbutylsulfanyl)hept-6-en-4-yn-3-ol Openeye Name: 1-isopentylsulfanyl-2,3,6-trimethyl-hept-6-en-4-yn-3-ol CAS Name: 2,3,6-trimethyl-1-(3-methylbutylthio)-3-hept-6-en-4-ynol IUPAC Name: 2,3,6-trimethyl-1-(3-methylbutylsulfanyl)hept-6-en-4-yn-3-ol Traditional Name: 1-(isoamylthio)-2,3,6-trimethyl-hept-6-en-4-yn-3-ol Formula: C15H26OS MolecularWeight: 254.43134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSCC(C)C(C)(C#CC(=C)C)O

Isomeric SMILES

CC(C)CCSCC(C)C(C)(C#CC(=C)C)O

InChI

InChI=1S/C15H26OS/c1-12(2)7-9-15(6,16)14(5)11-17-10-8-13(3)4/h13-14,16H,1,8,10-11H2,2-6H3