ethyl 5-azanyl-1-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-(2-morpholinoethylcarbamoyl)phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[[2-(4-morpholinyl)ethylamino]-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-(2-morpholinoethylcarbamoyl)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCN3CCOCC3)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCN3CCOCC3)N

InChI

InChI=1S/C19H25N5O4/c1-2-28-19(26)16-13-22-24(17(16)20)15-5-3-14(4-6-15)18(25)21-7-8-23-9-11-27-12-10-23/h3-6,13H,2,7-12,20H2,1H3,(H,21,25)