[3,5-dimethyl-4-(phenylsulfonylmethyl)pyrazol-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [3,5-dimethyl-4-(phenylsulfonylmethyl)pyrazol-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-(benzenesulfonylmethyl)-3,5-dimethyl-pyrazol-1-yl]-(3-pyridyl)methanone CAS Name: [4-(benzenesulfonylmethyl)-3,5-dimethyl-1-pyrazolyl]-(3-pyridinyl)methanone IUPAC Name: [4-(benzenesulfonylmethyl)-3,5-dimethylpyrazol-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-(besylmethyl)-3,5-dimethyl-pyrazol-1-yl]-(3-pyridyl)methanone Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CN=CC=C2)C)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CN=CC=C2)C)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3S/c1-13-17(12-25(23,24)16-8-4-3-5-9-16)14(2)21(20-13)18(22)15-7-6-10-19-11-15/h3-11H,12H2,1-2H3