5-tert-butyl-2-methyl-N-[1,1,4-tris(oxidanyl)thiolan-3-yl]pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-2-methyl-N-[1,1,4-tris(oxidanyl)thiolan-3-yl]pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-2-methyl-N-(1,1,4-trihydroxythiolan-3-yl)pyrazole-3-carboxamide CAS Name: 5-tert-butyl-2-methyl-N-(1,1,4-trihydroxy-3-thiolanyl)-3-pyrazolecarboxamide IUPAC Name: 5-tert-butyl-2-methyl-N-(1,1,4-trihydroxythiolan-3-yl)pyrazole-3-carboxamide Traditional Name: 5-tert-butyl-2-methyl-N-(1,1,4-trihydroxythiolan-3-yl)pyrazole-3-carboxamide Formula: C13H23N3O4S MolecularWeight: 317.40442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NC2CS(CC2O)(O)O)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NC2CS(CC2O)(O)O)C

InChI

InChI=1S/C13H23N3O4S/c1-13(2,3)11-5-9(16(4)15-11)12(18)14-8-6-21(19,20)7-10(8)17/h5,8,10,17,19-20H,6-7H2,1-4H3,(H,14,18)