ethyl 5-azanyl-1-[4-(4-fluorophenyl)phthalazin-1-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-(4-fluorophenyl)phthalazin-1-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-(4-fluorophenyl)phthalazin-1-yl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-(4-fluorophenyl)-1-phthalazinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-(4-fluorophenyl)phthalazin-1-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-(4-fluorophenyl)phthalazin-1-yl]pyrazole-4-carboxylic acid ethyl ester Formula: C20H16FN5O2 MolecularWeight: 377.371743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F)N

InChI

InChI=1S/C20H16FN5O2/c1-2-28-20(27)16-11-23-26(18(16)22)19-15-6-4-3-5-14(15)17(24-25-19)12-7-9-13(21)10-8-12/h3-11H,2,22H2,1H3