2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-(2-chloranyl-6-fluoranyl-phenyl)pyrazol-3-amine

Systemtic Name: 2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-(2-chloranyl-6-fluoranyl-phenyl)pyrazol-3-amine Openeye Name: 5-(2-chloro-6-fluoro-phenyl)-2-(1,1-dioxothiolan-3-yl)pyrazol-3-amine CAS Name: 5-(2-chloro-6-fluorophenyl)-2-(1,1-dioxo-3-thiolanyl)-3-pyrazolamine IUPAC Name: 5-(2-chloro-6-fluorophenyl)-2-(1,1-dioxothiolan-3-yl)pyrazol-3-amine Traditional Name: [5-(2-chloro-6-fluoro-phenyl)-2-(1,1-diketothiolan-3-yl)pyrazol-3-yl]amine Formula: C13H13ClFN3O2S MolecularWeight: 329.777623

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C(=CC(=N2)C3=C(C=CC=C3Cl)F)N

Isomeric SMILES

C1CS(=O)(=O)CC1N2C(=CC(=N2)C3=C(C=CC=C3Cl)F)N

InChI

InChI=1S/C13H13ClFN3O2S/c14-9-2-1-3-10(15)13(9)11-6-12(16)18(17-11)8-4-5-21(19,20)7-8/h1-3,6,8H,4-5,7,16H2