propan-2-yl 1-ethyl-4-[[3-(pyrazol-1-ylmethyl)phenyl]carbonylamino]pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 1-ethyl-4-[[3-(pyrazol-1-ylmethyl)phenyl]carbonylamino]pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-[[3-(pyrazol-1-ylmethyl)benzoyl]amino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[oxo-[3-(1-pyrazolylmethyl)phenyl]methyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-[[3-(pyrazol-1-ylmethyl)benzoyl]amino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[[3-(pyrazol-1-ylmethyl)benzoyl]amino]pyrazole-3-carboxylic acid isopropyl ester Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)CN3C=CC=N3

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)CN3C=CC=N3

InChI

InChI=1S/C20H23N5O3/c1-4-24-13-17(18(23-24)20(27)28-14(2)3)22-19(26)16-8-5-7-15(11-16)12-25-10-6-9-21-25/h5-11,13-14H,4,12H2,1-3H3,(H,22,26)