[5-azanyl-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] 2,2-dimethylpropanoate

Systemtic Name: [5-azanyl-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] 2,2-dimethylpropanoate Openeye Name: [5-amino-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [5-amino-1-(4-fluorophenyl)sulfonyl-3-pyrazolyl] ester IUPAC Name: [5-amino-1-(4-fluorophenyl)sulfonylpyrazol-3-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [5-amino-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] ester Formula: C14H16FN3O4S MolecularWeight: 341.357943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=NN(C(=C1)N)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)C(=O)OC1=NN(C(=C1)N)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H16FN3O4S/c1-14(2,3)13(19)22-12-8-11(16)18(17-12)23(20,21)10-6-4-9(15)5-7-10/h4-8H,16H2,1-3H3