N-[1,1-bis(oxidanylidene)thiolan-3-yl]-1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-1-(4-fluorophenyl)-3,5-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-1-(4-fluorophenyl)-3,5-dimethylpyrazole-4-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carboxamide Formula: C16H18FN3O3S MolecularWeight: 351.395823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)NC3CCS(=O)(=O)C3

InChI

InChI=1S/C16H18FN3O3S/c1-10-15(16(21)18-13-7-8-24(22,23)9-13)11(2)20(19-10)14-5-3-12(17)4-6-14/h3-6,13H,7-9H2,1-2H3,(H,18,21)