3-[(E)-2-(4-methoxyphenyl)ethenyl]-1,1-bis(methylsulfanyl)hex-1-en-5-yn-3-ol

Systemtic Name: 3-[(E)-2-(4-methoxyphenyl)ethenyl]-1,1-bis(methylsulfanyl)hex-1-en-5-yn-3-ol Openeye Name: 3-[(E)-2-(4-methoxyphenyl)vinyl]-1,1-bis(methylsulfanyl)hex-1-en-5-yn-3-ol CAS Name: 3-[(E)-2-(4-methoxyphenyl)ethenyl]-1,1-bis(methylthio)-3-hex-1-en-5-ynol IUPAC Name: 3-[(E)-2-(4-methoxyphenyl)ethenyl]-1,1-bis(methylsulfanyl)hex-1-en-5-yn-3-ol Traditional Name: 3-[(E)-2-(4-methoxyphenyl)vinyl]-1,1-bis(methylthio)hex-1-en-5-yn-3-ol Formula: C17H20O2S2 MolecularWeight: 320.4695

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(CC#C)(C=C(SC)SC)O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(CC#C)(C=C(SC)SC)O

InChI

InChI=1S/C17H20O2S2/c1-5-11-17(18,13-16(20-3)21-4)12-10-14-6-8-15(19-2)9-7-14/h1,6-10,12-13,18H,11H2,2-4H3/b12-10+