[5-[3-(2-methylpropylsulfinyl)phenyl]-3,4-dihydropyrazol-2-yl]-pyridin-3-yl-methanone

Systemtic Name: [5-[3-(2-methylpropylsulfinyl)phenyl]-3,4-dihydropyrazol-2-yl]-pyridin-3-yl-methanone Openeye Name: [5-(3-isobutylsulfinylphenyl)-3,4-dihydropyrazol-2-yl]-(3-pyridyl)methanone CAS Name: [5-[3-(2-methylpropylsulfinyl)phenyl]-3,4-dihydropyrazol-2-yl]-(3-pyridinyl)methanone IUPAC Name: [5-[3-(2-methylpropylsulfinyl)phenyl]-3,4-dihydropyrazol-2-yl]-pyridin-3-ylmethanone Traditional Name: [3-(3-isobutylsulfinylphenyl)-2-pyrazolin-1-yl]-(3-pyridyl)methanone Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)C1=CC=CC(=C1)C2=NN(CC2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)CS(=O)C1=CC=CC(=C1)C2=NN(CC2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H21N3O2S/c1-14(2)13-25(24)17-7-3-5-15(11-17)18-8-10-22(21-18)19(23)16-6-4-9-20-12-16/h3-7,9,11-12,14H,8,10,13H2,1-2H3