N-[1,1-bis(oxidanylidene)thiolan-3-yl]-1-(4-chlorophenyl)-5-propan-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-1-(4-chlorophenyl)-5-propan-2-yl-pyrazole-4-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-(1,1-dioxothiolan-3-yl)-5-isopropyl-pyrazole-4-carboxamide CAS Name: 1-(4-chlorophenyl)-N-(1,1-dioxo-3-thiolanyl)-5-propan-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-(1,1-dioxothiolan-3-yl)-5-propan-2-ylpyrazole-4-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-(1,1-diketothiolan-3-yl)-5-isopropyl-pyrazole-4-carboxamide Formula: C17H20ClN3O3S MolecularWeight: 381.877

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3CCS(=O)(=O)C3

InChI

InChI=1S/C17H20ClN3O3S/c1-11(2)16-15(17(22)20-13-7-8-25(23,24)10-13)9-19-21(16)14-5-3-12(18)4-6-14/h3-6,9,11,13H,7-8,10H2,1-2H3,(H,20,22)