methyl 4-[[methyl-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[methyl-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonyl-amino]methyl]benzoate Openeye Name: methyl 4-[[methyl-[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]amino]methyl]benzoate CAS Name: 4-[[methyl-[oxo-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[methyl-(1-phenyl-3-pyridin-3-ylpyrazole-4-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[methyl-[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]amino]methyl]benzoic acid methyl ester Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O3/c1-28(16-18-10-12-19(13-11-18)25(31)32-2)24(30)22-17-29(21-8-4-3-5-9-21)27-23(22)20-7-6-14-26-15-20/h3-15,17H,16H2,1-2H3