(3R,4S)-1-phenyl-4-phenylsulfanyl-hex-5-en-1-yn-3-ol

Systemtic Name: (3R,4S)-1-phenyl-4-phenylsulfanyl-hex-5-en-1-yn-3-ol Openeye Name: (3R,4S)-1-phenyl-4-phenylsulfanyl-hex-5-en-1-yn-3-ol CAS Name: (3R,4S)-1-phenyl-4-(phenylthio)-3-hex-5-en-1-ynol IUPAC Name: (3R,4S)-1-phenyl-4-phenylsulfanylhex-5-en-1-yn-3-ol Traditional Name: (3R,4S)-1-phenyl-4-(phenylthio)hex-5-en-1-yn-3-ol Formula: C18H16OS MolecularWeight: 280.38404

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C(C#CC1=CC=CC=C1)O)SC2=CC=CC=C2

Isomeric SMILES

C=C[C@@H]([C@@H](C#CC1=CC=CC=C1)O)SC2=CC=CC=C2

InChI

InChI=1S/C18H16OS/c1-2-18(20-16-11-7-4-8-12-16)17(19)14-13-15-9-5-3-6-10-15/h2-12,17-19H,1H2/t17-,18+/m1/s1