(E)-4-[1-phenyl-5-(phenylsulfonylmethyl)pyrazol-3-yl]but-3-en-1-ol

Systemtic Name: (E)-4-[1-phenyl-5-(phenylsulfonylmethyl)pyrazol-3-yl]but-3-en-1-ol Openeye Name: (E)-4-[5-(benzenesulfonylmethyl)-1-phenyl-pyrazol-3-yl]but-3-en-1-ol CAS Name: (E)-4-[5-(benzenesulfonylmethyl)-1-phenyl-3-pyrazolyl]-3-buten-1-ol IUPAC Name: (E)-4-[5-(benzenesulfonylmethyl)-1-phenylpyrazol-3-yl]but-3-en-1-ol Traditional Name: (E)-4-[5-(besylmethyl)-1-phenyl-pyrazol-3-yl]but-3-en-1-ol Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC(=N2)C=CCCO)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC(=N2)/C=C/CCO)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c23-14-8-7-9-17-15-19(22(21-17)18-10-3-1-4-11-18)16-26(24,25)20-12-5-2-6-13-20/h1-7,9-13,15,23H,8,14,16H2/b9-7+