N-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-1-[[2-(4-tert-butylphenyl)-5-pyridin-3-yl-pyrazol-3-yl]methyl]piperidine-4-carboxamide

Systemtic Name: N-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-1-[[2-(4-tert-butylphenyl)-5-pyridin-3-yl-pyrazol-3-yl]methyl]piperidine-4-carboxamide Openeye Name: N-[2-amino-3-(4-hydroxyphenyl)propanoyl]-1-[[2-(4-tert-butylphenyl)-5-(3-pyridyl)pyrazol-3-yl]methyl]piperidine-4-carboxamide CAS Name: N-[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-1-[[2-(4-tert-butylphenyl)-5-(3-pyridinyl)-3-pyrazolyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-amino-3-(4-hydroxyphenyl)propanoyl]-1-[[2-(4-tert-butylphenyl)-5-pyridin-3-ylpyrazol-3-yl]methyl]piperidine-4-carboxamide Traditional Name: 1-[[2-(4-tert-butylphenyl)-5-(3-pyridyl)pyrazol-3-yl]methyl]-N-tyrosyl-isonipecotamide Formula: C34H40N6O3 MolecularWeight: 580.7198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C(=CC(=N2)C3=CN=CC=C3)CN4CCC(CC4)C(=O)NC(=O)C(CC5=CC=C(C=C5)O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=CC(=N2)C3=CN=CC=C3)CN4CCC(CC4)C(=O)NC(=O)C(CC5=CC=C(C=C5)O)N

InChI

InChI=1S/C34H40N6O3/c1-34(2,3)26-8-10-27(11-9-26)40-28(20-31(38-40)25-5-4-16-36-21-25)22-39-17-14-24(15-18-39)32(42)37-33(43)30(35)19-23-6-12-29(41)13-7-23/h4-13,16,20-21,24,30,41H,14-15,17-19,22,35H2,1-3H3,(H,37,42,43)