(phenylmethyl) 4-[[5-[(4-morpholin-4-ylcarbonyl-3-naphthalen-1-yl-pyrazol-1-yl)methyl]imidazol-1-yl]methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[5-[(4-morpholin-4-ylcarbonyl-3-naphthalen-1-yl-pyrazol-1-yl)methyl]imidazol-1-yl]methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[[5-[[4-(morpholine-4-carbonyl)-3-(1-naphthyl)pyrazol-1-yl]methyl]imidazol-1-yl]methyl]piperidine-1-carboxylate CAS Name: 4-[[5-[[4-[4-morpholinyl(oxo)methyl]-3-(1-naphthalenyl)-1-pyrazolyl]methyl]-1-imidazolyl]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[5-[[4-(morpholine-4-carbonyl)-3-naphthalen-1-ylpyrazol-1-yl]methyl]imidazol-1-yl]methyl]piperidine-1-carboxylate Traditional Name: 4-[[5-[[4-(morpholine-4-carbonyl)-3-(1-naphthyl)pyrazol-1-yl]methyl]imidazol-1-yl]methyl]piperidine-1-carboxylic acid benzyl ester Formula: C36H38N6O4 MolecularWeight: 618.72472

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C=NC=C2CN3C=C(C(=N3)C4=CC=CC5=CC=CC=C54)C(=O)N6CCOCC6)C(=O)OCC7=CC=CC=C7

Isomeric SMILES

C1CN(CCC1CN2C=NC=C2CN3C=C(C(=N3)C4=CC=CC5=CC=CC=C54)C(=O)N6CCOCC6)C(=O)OCC7=CC=CC=C7

InChI

InChI=1S/C36H38N6O4/c43-35(39-17-19-45-20-18-39)33-24-42(38-34(33)32-12-6-10-29-9-4-5-11-31(29)32)23-30-21-37-26-41(30)22-27-13-15-40(16-14-27)36(44)46-25-28-7-2-1-3-8-28/h1-12,21,24,26-27H,13-20,22-23,25H2