[4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-2-[(E)-prop-1-enyl]pyrazol-3-yl]methanol

Systemtic Name: [4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-2-[(E)-prop-1-enyl]pyrazol-3-yl]methanol Openeye Name: [5-(4-methylsulfonylphenyl)-2-[(E)-prop-1-enyl]-4-(p-tolyl)pyrazol-3-yl]methanol CAS Name: [4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-2-[(E)-prop-1-enyl]-3-pyrazolyl]methanol IUPAC Name: [4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-2-[(E)-prop-1-enyl]pyrazol-3-yl]methanol Traditional Name: [5-(4-mesylphenyl)-2-[(E)-prop-1-enyl]-4-(p-tolyl)pyrazol-3-yl]methanol Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC=CN1C(=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)C)CO

Isomeric SMILES

C/C=C/N1C(=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)C)CO

InChI

InChI=1S/C21H22N2O3S/c1-4-13-23-19(14-24)20(16-7-5-15(2)6-8-16)21(22-23)17-9-11-18(12-10-17)27(3,25)26/h4-13,24H,14H2,1-3H3/b13-4+