ethyl 5-azanyl-1-[4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[[(1-ethyl-2-pyrrolidinyl)methylamino]-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OCC)N

Isomeric SMILES

CCN1CCCC1CNC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OCC)N

InChI

InChI=1S/C20H27N5O3/c1-3-24-11-5-6-16(24)12-22-19(26)14-7-9-15(10-8-14)25-18(21)17(13-23-25)20(27)28-4-2/h7-10,13,16H,3-6,11-12,21H2,1-2H3,(H,22,26)