butyl 4-[(5-methyl-1,3-diphenyl-pyrazol-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(5-methyl-1,3-diphenyl-pyrazol-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(5-methyl-1,3-diphenyl-pyrazole-4-carbonyl)amino]benzoate CAS Name: 4-[[(5-methyl-1,3-diphenyl-4-pyrazolyl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(5-methyl-1,3-diphenylpyrazole-4-carbonyl)amino]benzoate Traditional Name: 4-[(5-methyl-1,3-diphenyl-pyrazole-4-carbonyl)amino]benzoic acid butyl ester Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C28H27N3O3/c1-3-4-19-34-28(33)22-15-17-23(18-16-22)29-27(32)25-20(2)31(24-13-9-6-10-14-24)30-26(25)21-11-7-5-8-12-21/h5-18H,3-4,19H2,1-2H3,(H,29,32)