[1-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-1-oxidanylidene-propan-2-yl] 3-(pyridin-3-ylcarbonylamino)benzoate

Systemtic Name: [1-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-1-oxidanylidene-propan-2-yl] 3-(pyridin-3-ylcarbonylamino)benzoate Openeye Name: [2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-1-methyl-2-oxo-ethyl] 3-(pyridine-3-carbonylamino)benzoate CAS Name: 3-[[oxo(3-pyridinyl)methyl]amino]benzoic acid [1-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-1-oxopropan-2-yl] 3-(pyridine-3-carbonylamino)benzoate Traditional Name: 3-nicotinamidobenzoic acid [2-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-1-methyl-ethyl] ester Formula: C27H25N5O5 MolecularWeight: 499.5179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C)OC(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C)OC(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C27H25N5O5/c1-17-23(26(35)32(31(17)3)22-12-5-4-6-13-22)30-24(33)18(2)37-27(36)19-9-7-11-21(15-19)29-25(34)20-10-8-14-28-16-20/h4-16,18H,1-3H3,(H,29,34)(H,30,33)