[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-(dimethylamino)pyridine-4-carboxylate

Systemtic Name: [2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-(dimethylamino)pyridine-4-carboxylate Openeye Name: [2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxo-ethyl] 2-(dimethylamino)pyridine-4-carboxylate CAS Name: 2-(dimethylamino)-4-pyridinecarboxylic acid [2-[(2,5-diphenyl-3-pyrazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxoethyl] 2-(dimethylamino)pyridine-4-carboxylate Traditional Name: 2-(dimethylamino)isonicotinic acid [2-[(2,5-diphenylpyrazol-3-yl)amino]-2-keto-ethyl] ester Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=CC(=C1)C(=O)OCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1=NC=CC(=C1)C(=O)OCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N5O3/c1-29(2)22-15-19(13-14-26-22)25(32)33-17-24(31)27-23-16-21(18-9-5-3-6-10-18)28-30(23)20-11-7-4-8-12-20/h3-16H,17H2,1-2H3,(H,27,31)