4-[5-chloranyl-3-(3-methylsulfonylphenyl)pyridin-2-yl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[5-chloranyl-3-(3-methylsulfonylphenyl)pyridin-2-yl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[5-chloro-3-(3-methylsulfonylphenyl)-2-pyridyl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[5-chloro-3-(3-methylsulfonylphenyl)-2-pyridinyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[5-chloro-3-(3-methylsulfonylphenyl)pyridin-2-yl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[5-chloro-3-(3-mesylphenyl)-2-pyridyl]-2-methyl-but-3-yn-2-ol Formula: C17H16ClNO3S MolecularWeight: 349.83184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=NC=C(C=C1C2=CC(=CC=C2)S(=O)(=O)C)Cl)O

Isomeric SMILES

CC(C)(C#CC1=NC=C(C=C1C2=CC(=CC=C2)S(=O)(=O)C)Cl)O

InChI

InChI=1S/C17H16ClNO3S/c1-17(2,20)8-7-16-15(10-13(18)11-19-16)12-5-4-6-14(9-12)23(3,21)22/h4-6,9-11,20H,1-3H3