methyl (2S,4R)-1-(naphthalen-2-ylmethyl)-4-[(4-pyrazol-1-ylphenyl)carbonylamino]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R)-1-(naphthalen-2-ylmethyl)-4-[(4-pyrazol-1-ylphenyl)carbonylamino]pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R)-1-(2-naphthylmethyl)-4-[(4-pyrazol-1-ylbenzoyl)amino]pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-(2-naphthalenylmethyl)-4-[[oxo-[4-(1-pyrazolyl)phenyl]methyl]amino]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-1-(naphthalen-2-ylmethyl)-4-[(4-pyrazol-1-ylbenzoyl)amino]pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-1-(2-naphthylmethyl)-4-[(4-pyrazol-1-ylbenzoyl)amino]pyrrolidine-2-carboxylic acid methyl ester Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1CC2=CC3=CC=CC=C3C=C2)NC(=O)C4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

COC(=O)[C@@H]1C[C@H](CN1CC2=CC3=CC=CC=C3C=C2)NC(=O)C4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C27H26N4O3/c1-34-27(33)25-16-23(18-30(25)17-19-7-8-20-5-2-3-6-22(20)15-19)29-26(32)21-9-11-24(12-10-21)31-14-4-13-28-31/h2-15,23,25H,16-18H2,1H3,(H,29,32)/t23-,25+/m1/s1