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

Systemtic Name: (E)-4-[1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]but-3-en-1-ol Openeye Name: (E)-4-[1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]but-3-en-1-ol CAS Name: (E)-4-[1-cyclohexyl-5-(4-methylsulfonylphenyl)-3-pyrazolyl]-3-buten-1-ol IUPAC Name: (E)-4-[1-cyclohexyl-5-(4-methylsulfonylphenyl)pyrazol-3-yl]but-3-en-1-ol Traditional Name: (E)-4-[1-cyclohexyl-5-(4-mesylphenyl)pyrazol-3-yl]but-3-en-1-ol Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3CCCCC3)C=CCCO

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3CCCCC3)/C=C/CCO

InChI

InChI=1S/C20H26N2O3S/c1-26(24,25)19-12-10-16(11-13-19)20-15-17(7-5-6-14-23)21-22(20)18-8-3-2-4-9-18/h5,7,10-13,15,18,23H,2-4,6,8-9,14H2,1H3/b7-5+