(E)-4-[3-(4-methylsulfonylphenyl)-5-pyridin-3-yl-pyrazol-3-yl]but-3-en-1-ol

Systemtic Name: (E)-4-[3-(4-methylsulfonylphenyl)-5-pyridin-3-yl-pyrazol-3-yl]but-3-en-1-ol Openeye Name: (E)-4-[3-(4-methylsulfonylphenyl)-5-(3-pyridyl)pyrazol-3-yl]but-3-en-1-ol CAS Name: (E)-4-[3-(4-methylsulfonylphenyl)-5-(3-pyridinyl)-3-pyrazolyl]-3-buten-1-ol IUPAC Name: (E)-4-[3-(4-methylsulfonylphenyl)-5-pyridin-3-ylpyrazol-3-yl]but-3-en-1-ol Traditional Name: (E)-4-[3-(4-mesylphenyl)-5-(3-pyridyl)pyrazol-3-yl]but-3-en-1-ol Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2(C=C(N=N2)C3=CN=CC=C3)C=CCCO

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2(C=C(N=N2)C3=CN=CC=C3)/C=C/CCO

InChI

InChI=1S/C19H19N3O3S/c1-26(24,25)17-8-6-16(7-9-17)19(10-2-3-12-23)13-18(21-22-19)15-5-4-11-20-14-15/h2,4-11,13-14,23H,3,12H2,1H3/b10-2+