[2-tert-butyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] 3,3-dimethylbutanoate

Systemtic Name: [2-tert-butyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] 3,3-dimethylbutanoate Openeye Name: [2-tert-butyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-tert-butyl-4-[(1-phenyl-3-pyrazolyl)amino]phenyl] ester IUPAC Name: [2-tert-butyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-tert-butyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] ester Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=C(C=C(C=C1)NC2=NN(C=C2)C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC(C)(C)CC(=O)OC1=C(C=C(C=C1)NC2=NN(C=C2)C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C25H31N3O2/c1-24(2,3)17-23(29)30-21-13-12-18(16-20(21)25(4,5)6)26-22-14-15-28(27-22)19-10-8-7-9-11-19/h7-16H,17H2,1-6H3,(H,26,27)