4-[2-(4-dimethylaminophenyl)-5-methoxy-1-benzothiophen-3-yl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[2-(4-dimethylaminophenyl)-5-methoxy-1-benzothiophen-3-yl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[2-(4-dimethylaminophenyl)-5-methoxy-benzothiophen-3-yl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[2-(4-dimethylaminophenyl)-5-methoxy-1-benzothiophen-3-yl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[2-(4-dimethylaminophenyl)-5-methoxy-1-benzothiophen-3-yl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[2-(4-dimethylaminophenyl)-5-methoxy-benzothiophen-3-yl]-2-methyl-but-3-yn-2-ol Formula: C22H23NO2S MolecularWeight: 365.48852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=C(SC2=C1C=C(C=C2)OC)C3=CC=C(C=C3)N(C)C)O

Isomeric SMILES

CC(C)(C#CC1=C(SC2=C1C=C(C=C2)OC)C3=CC=C(C=C3)N(C)C)O

InChI

InChI=1S/C22H23NO2S/c1-22(2,24)13-12-18-19-14-17(25-5)10-11-20(19)26-21(18)15-6-8-16(9-7-15)23(3)4/h6-11,14,24H,1-5H3