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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-1-(3-chlorophenyl)-5-ethyl-pyrazole-4-carboxamide Openeye Name: 1-(3-chlorophenyl)-N-(1,1-dioxothiolan-3-yl)-5-ethyl-pyrazole-4-carboxamide CAS Name: 1-(3-chlorophenyl)-N-(1,1-dioxo-3-thiolanyl)-5-ethyl-4-pyrazolecarboxamide IUPAC Name: 1-(3-chlorophenyl)-N-(1,1-dioxothiolan-3-yl)-5-ethylpyrazole-4-carboxamide Traditional Name: 1-(3-chlorophenyl)-N-(1,1-diketothiolan-3-yl)-5-ethyl-pyrazole-4-carboxamide Formula: C16H18ClN3O3S MolecularWeight: 367.85042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NC3CCS(=O)(=O)C3

InChI

InChI=1S/C16H18ClN3O3S/c1-2-15-14(16(21)19-12-6-7-24(22,23)10-12)9-18-20(15)13-5-3-4-11(17)8-13/h3-5,8-9,12H,2,6-7,10H2,1H3,(H,19,21)