(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 5-(tert-butylsulfamoyl)furan-2-carboxylate

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 5-(tert-butylsulfamoyl)furan-2-carboxylate Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl 5-(tert-butylsulfamoyl)furan-2-carboxylate CAS Name: 5-(tert-butylsulfamoyl)-2-furancarboxylic acid (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl 5-(tert-butylsulfamoyl)furan-2-carboxylate Traditional Name: 5-(tert-butylsulfamoyl)furan-2-carboxylic acid (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C20H22ClN3O5S MolecularWeight: 451.92378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1COC(=O)C2=CC=C(O2)S(=O)(=O)NC(C)(C)C)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1COC(=O)C2=CC=C(O2)S(=O)(=O)NC(C)(C)C)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H22ClN3O5S/c1-13-15(18(21)24(22-13)14-8-6-5-7-9-14)12-28-19(25)16-10-11-17(29-16)30(26,27)23-20(2,3)4/h5-11,23H,12H2,1-4H3