methyl (2S,4S)-1-[(3-methylphenyl)methyl]-4-[(4-pyrazol-1-ylphenyl)carbonylamino]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4S)-1-[(3-methylphenyl)methyl]-4-[(4-pyrazol-1-ylphenyl)carbonylamino]pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S)-1-(m-tolylmethyl)-4-[(4-pyrazol-1-ylbenzoyl)amino]pyrrolidine-2-carboxylate CAS Name: (2S,4S)-1-[(3-methylphenyl)methyl]-4-[[oxo-[4-(1-pyrazolyl)phenyl]methyl]amino]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-1-[(3-methylphenyl)methyl]-4-[(4-pyrazol-1-ylbenzoyl)amino]pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-(3-methylbenzyl)-4-[(4-pyrazol-1-ylbenzoyl)amino]pyrrolidine-2-carboxylic acid methyl ester Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CC(CC2C(=O)OC)NC(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC1=CC(=CC=C1)CN2C[C@H](C[C@H]2C(=O)OC)NC(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C24H26N4O3/c1-17-5-3-6-18(13-17)15-27-16-20(14-22(27)24(30)31-2)26-23(29)19-7-9-21(10-8-19)28-12-4-11-25-28/h3-13,20,22H,14-16H2,1-2H3,(H,26,29)/t20-,22-/m0/s1