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

Systemtic Name: ethyl 5-azanyl-1-[4-(4-methylphenyl)phthalazin-1-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-(p-tolyl)phthalazin-1-yl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-(4-methylphenyl)-1-phthalazinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-(4-methylphenyl)phthalazin-1-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-(p-tolyl)phthalazin-1-yl]pyrazole-4-carboxylic acid ethyl ester Formula: C21H19N5O2 MolecularWeight: 373.40786

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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)C)N

Isomeric SMILES

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

InChI

InChI=1S/C21H19N5O2/c1-3-28-21(27)17-12-23-26(19(17)22)20-16-7-5-4-6-15(16)18(24-25-20)14-10-8-13(2)9-11-14/h4-12H,3,22H2,1-2H3