(2S)-4-(1-adamantyl)-2-thiophen-2-yl-but-3-yn-2-ol

Systemtic Name: (2S)-4-(1-adamantyl)-2-thiophen-2-yl-but-3-yn-2-ol Openeye Name: (2S)-4-(1-adamantyl)-2-(2-thienyl)but-3-yn-2-ol CAS Name: (2S)-4-(1-adamantyl)-2-thiophen-2-yl-3-butyn-2-ol IUPAC Name: (2S)-4-(1-adamantyl)-2-thiophen-2-ylbut-3-yn-2-ol Traditional Name: (2S)-4-(1-adamantyl)-2-(2-thienyl)but-3-yn-2-ol Formula: C18H22OS MolecularWeight: 286.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC12CC3CC(C1)CC(C3)C2)(C4=CC=CS4)O

Isomeric SMILES

C[C@](C#CC12CC3CC(C1)CC(C3)C2)(C4=CC=CS4)O

InChI

InChI=1S/C18H22OS/c1-17(19,16-3-2-6-20-16)4-5-18-10-13-7-14(11-18)9-15(8-13)12-18/h2-3,6,13-15,19H,7-12H2,1H3/t13?,14?,15?,17-,18?/m0/s1