tert-butyl 3-[[(2E)-2-(4-cyclopropylsulfonylphenyl)-2-[(3R)-oxolan-3-yl]oxyimino-ethanoyl]amino]pyrazole-1-carboxylate

Systemtic Name: tert-butyl 3-[[(2E)-2-(4-cyclopropylsulfonylphenyl)-2-[(3R)-oxolan-3-yl]oxyimino-ethanoyl]amino]pyrazole-1-carboxylate Openeye Name: tert-butyl 3-[[(2E)-2-(4-cyclopropylsulfonylphenyl)-2-[(3R)-tetrahydrofuran-3-yl]oxyimino-acetyl]amino]pyrazole-1-carboxylate CAS Name: 3-[[(2E)-2-(4-cyclopropylsulfonylphenyl)-1-oxo-2-[[(3R)-3-oxolanyl]oxyimino]ethyl]amino]-1-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[(2E)-2-(4-cyclopropylsulfonylphenyl)-2-[(3R)-oxolan-3-yl]oxyiminoacetyl]amino]pyrazole-1-carboxylate Traditional Name: 3-[[(2E)-2-(4-cyclopropylsulfonylphenyl)-2-[(3R)-tetrahydrofuran-3-yl]oximino-acetyl]amino]pyrazole-1-carboxylic acid tert-butyl ester Formula: C23H28N4O7S MolecularWeight: 504.55602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC(=N1)NC(=O)C(=NOC2CCOC2)C3=CC=C(C=C3)S(=O)(=O)C4CC4

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC(=N1)NC(=O)/C(=N/O[C@@H]2CCOC2)/C3=CC=C(C=C3)S(=O)(=O)C4CC4

InChI

InChI=1S/C23H28N4O7S/c1-23(2,3)33-22(29)27-12-10-19(25-27)24-21(28)20(26-34-16-11-13-32-14-16)15-4-6-17(7-5-15)35(30,31)18-8-9-18/h4-7,10,12,16,18H,8-9,11,13-14H2,1-3H3,(H,24,25,28)/b26-20+/t16-/m1/s1