3-[1-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)pyrazol-4-yl]propyl 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: 3-[1-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)pyrazol-4-yl]propyl 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate Openeye Name: 3-[1-(p-tolylsulfonyl)-3-(trifluoromethyl)pyrazol-4-yl]propyl 5-amino-3-methyl-isoxazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isoxazolecarboxylic acid 3-[1-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)-4-pyrazolyl]propyl ester IUPAC Name: 3-[1-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)pyrazol-4-yl]propyl 5-amino-3-methyl-1,2-oxazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isoxazole-4-carboxylic acid 3-[1-tosyl-3-(trifluoromethyl)pyrazol-4-yl]propyl ester Formula: C19H19F3N4O5S MolecularWeight: 472.43817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C(=N2)C(F)(F)F)CCCOC(=O)C3=C(ON=C3C)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C(=N2)C(F)(F)F)CCCOC(=O)C3=C(ON=C3C)N

InChI

InChI=1S/C19H19F3N4O5S/c1-11-5-7-14(8-6-11)32(28,29)26-10-13(16(24-26)19(20,21)22)4-3-9-30-18(27)15-12(2)25-31-17(15)23/h5-8,10H,3-4,9,23H2,1-2H3