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

Systemtic Name: methyl 5-azanyl-1-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]pyrazole-4-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C18H23N5O4 MolecularWeight: 373.40632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N5O4/c1-26-18(25)15-12-21-23(16(15)19)14-4-2-13(3-5-14)17(24)20-6-7-22-8-10-27-11-9-22/h2-5,12H,6-11,19H2,1H3,(H,20,24)