(5-tert-butyl-2-ethyl-pyrazol-3-yl)-[4-(phenylsulfonyl)piperidin-1-yl]methanone

Systemtic Name: (5-tert-butyl-2-ethyl-pyrazol-3-yl)-[4-(phenylsulfonyl)piperidin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)-1-piperidyl]-(5-tert-butyl-2-ethyl-pyrazol-3-yl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperidinyl]-(5-tert-butyl-2-ethyl-3-pyrazolyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperidin-1-yl]-(5-tert-butyl-2-ethylpyrazol-3-yl)methanone Traditional Name: (4-besylpiperidino)-(5-tert-butyl-2-ethyl-pyrazol-3-yl)methanone Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C(C)(C)C)C(=O)N2CCC(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=CC(=N1)C(C)(C)C)C(=O)N2CCC(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H29N3O3S/c1-5-24-18(15-19(22-24)21(2,3)4)20(25)23-13-11-17(12-14-23)28(26,27)16-9-7-6-8-10-16/h6-10,15,17H,5,11-14H2,1-4H3