ethyl 4-[[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-4-yl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-4-yl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-4-yl]carbamoylamino]benzoate CAS Name: 4-[[[[1-[(2-chloro-6-fluorophenyl)methyl]-4-pyrazolyl]amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-4-yl]carbamoylamino]benzoate Traditional Name: 4-[[1-(2-chloro-6-fluoro-benzyl)pyrazol-4-yl]carbamoylamino]benzoic acid ethyl ester Formula: C20H18ClFN4O3 MolecularWeight: 416.833323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CN(N=C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CN(N=C2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H18ClFN4O3/c1-2-29-19(27)13-6-8-14(9-7-13)24-20(28)25-15-10-23-26(11-15)12-16-17(21)4-3-5-18(16)22/h3-11H,2,12H2,1H3,(H2,24,25,28)