5-[2-methyl-3-[4-(trifluoromethyl)phenyl]-1-benzothiophen-6-yl]pent-4-yn-1-ol

Systemtic Name: 5-[2-methyl-3-[4-(trifluoromethyl)phenyl]-1-benzothiophen-6-yl]pent-4-yn-1-ol Openeye Name: 5-[2-methyl-3-[4-(trifluoromethyl)phenyl]benzothiophen-6-yl]pent-4-yn-1-ol CAS Name: 5-[2-methyl-3-[4-(trifluoromethyl)phenyl]-1-benzothiophen-6-yl]-4-pentyn-1-ol IUPAC Name: 5-[2-methyl-3-[4-(trifluoromethyl)phenyl]-1-benzothiophen-6-yl]pent-4-yn-1-ol Traditional Name: 5-[2-methyl-3-[4-(trifluoromethyl)phenyl]benzothiophen-6-yl]pent-4-yn-1-ol Formula: C21H17F3OS MolecularWeight: 374.41929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)C=C(C=C2)C#CCCCO)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C2=C(S1)C=C(C=C2)C#CCCCO)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H17F3OS/c1-14-20(16-7-9-17(10-8-16)21(22,23)24)18-11-6-15(13-19(18)26-14)5-3-2-4-12-25/h6-11,13,25H,2,4,12H2,1H3