2-[1-[(4-methylsulfonylphenyl)methyl]pyrazol-4-yl]quinoline

Systemtic Name: 2-[1-[(4-methylsulfonylphenyl)methyl]pyrazol-4-yl]quinoline Openeye Name: 2-[1-[(4-methylsulfonylphenyl)methyl]pyrazol-4-yl]quinoline CAS Name: 2-[1-[(4-methylsulfonylphenyl)methyl]-4-pyrazolyl]quinoline IUPAC Name: 2-[1-[(4-methylsulfonylphenyl)methyl]pyrazol-4-yl]quinoline Traditional Name: 2-[1-(4-mesylbenzyl)pyrazol-4-yl]quinoline Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CN2C=C(C=N2)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CN2C=C(C=N2)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H17N3O2S/c1-26(24,25)18-9-6-15(7-10-18)13-23-14-17(12-21-23)20-11-8-16-4-2-3-5-19(16)22-20/h2-12,14H,13H2,1H3