methyl 2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonylamino]benzoate Openeye Name: methyl 2-[(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)amino]benzoate CAS Name: 2-[[oxo-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)amino]benzoate Traditional Name: 2-[(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)amino]benzoic acid methyl ester Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C22H18N4O3/c1-29-22(28)17-11-5-6-12-19(17)24-20(27)18-15-23-26(16-9-3-2-4-10-16)21(18)25-13-7-8-14-25/h2-15H,1H3,(H,24,27)