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

Systemtic Name: N-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-3-[2-[(4-tert-butylphenyl)methyl]-5-pyridin-4-yl-pyrazol-3-yl]benzamide Openeye Name: N-[2-amino-3-(4-hydroxyphenyl)propanoyl]-3-[2-[(4-tert-butylphenyl)methyl]-5-(4-pyridyl)pyrazol-3-yl]benzamide CAS Name: N-[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-3-[2-[(4-tert-butylphenyl)methyl]-5-pyridin-4-yl-3-pyrazolyl]benzamide IUPAC Name: N-[2-amino-3-(4-hydroxyphenyl)propanoyl]-3-[2-[(4-tert-butylphenyl)methyl]-5-pyridin-4-ylpyrazol-3-yl]benzamide Traditional Name: 3-[2-(4-tert-butylbenzyl)-5-(4-pyridyl)pyrazol-3-yl]-N-tyrosyl-benzamide Formula: C35H35N5O3 MolecularWeight: 573.6841

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C(=CC(=N2)C3=CC=NC=C3)C4=CC(=CC=C4)C(=O)NC(=O)C(CC5=CC=C(C=C5)O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C(=CC(=N2)C3=CC=NC=C3)C4=CC(=CC=C4)C(=O)NC(=O)C(CC5=CC=C(C=C5)O)N

InChI

InChI=1S/C35H35N5O3/c1-35(2,3)28-11-7-24(8-12-28)22-40-32(21-31(39-40)25-15-17-37-18-16-25)26-5-4-6-27(20-26)33(42)38-34(43)30(36)19-23-9-13-29(41)14-10-23/h4-18,20-21,30,41H,19,22,36H2,1-3H3,(H,38,42,43)