ethyl 1-[4-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]phenyl]-5-pyrrol-1-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]phenyl]-5-pyrrol-1-yl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[(2-chloro-6-fluoro-benzoyl)amino]phenyl]-5-pyrrol-1-yl-pyrazole-4-carboxylate CAS Name: 1-[4-[[(2-chloro-6-fluorophenyl)-oxomethyl]amino]phenyl]-5-(1-pyrrolyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(2-chloro-6-fluorobenzoyl)amino]phenyl]-5-pyrrol-1-ylpyrazole-4-carboxylate Traditional Name: 1-[4-[(2-chloro-6-fluoro-benzoyl)amino]phenyl]-5-pyrrol-1-yl-pyrazole-4-carboxylic acid ethyl ester Formula: C23H18ClFN4O3 MolecularWeight: 452.865423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)NC(=O)C3=C(C=CC=C3Cl)F)N4C=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)NC(=O)C3=C(C=CC=C3Cl)F)N4C=CC=C4

InChI

InChI=1S/C23H18ClFN4O3/c1-2-32-23(31)17-14-26-29(22(17)28-12-3-4-13-28)16-10-8-15(9-11-16)27-21(30)20-18(24)6-5-7-19(20)25/h3-14H,2H2,1H3,(H,27,30)