tert-butyl N-[[4-[[(4-oxidanyl-1-phenyl-pyrazol-3-yl)carbonylamino]carbamoyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[[(4-oxidanyl-1-phenyl-pyrazol-3-yl)carbonylamino]carbamoyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[[(4-hydroxy-1-phenyl-3-pyrazolyl)-oxomethyl]hydrazo]-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[[(4-hydroxy-1-phenylpyrazole-3-carbonyl)amino]carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[[(4-hydroxy-1-phenyl-pyrazole-3-carbonyl)amino]carbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C23H25N5O5 MolecularWeight: 451.4751

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NNC(=O)C2=NN(C=C2O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NNC(=O)C2=NN(C=C2O)C3=CC=CC=C3

InChI

InChI=1S/C23H25N5O5/c1-23(2,3)33-22(32)24-13-15-9-11-16(12-10-15)20(30)25-26-21(31)19-18(29)14-28(27-19)17-7-5-4-6-8-17/h4-12,14,29H,13H2,1-3H3,(H,24,32)(H,25,30)(H,26,31)