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

Systemtic Name: N-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-3-[2-[(4-tert-butylphenyl)methyl]-5-pyridin-3-yl-pyrazol-3-yl]benzamide Openeye Name: N-[2-amino-3-(4-hydroxyphenyl)propanoyl]-3-[2-[(4-tert-butylphenyl)methyl]-5-(3-pyridyl)pyrazol-3-yl]benzamide CAS Name: N-[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-3-[2-[(4-tert-butylphenyl)methyl]-5-(3-pyridinyl)-3-pyrazolyl]benzamide IUPAC Name: N-[2-amino-3-(4-hydroxyphenyl)propanoyl]-3-[2-[(4-tert-butylphenyl)methyl]-5-pyridin-3-ylpyrazol-3-yl]benzamide Traditional Name: 3-[2-(4-tert-butylbenzyl)-5-(3-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=CN=CC=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=CN=CC=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)28-13-9-24(10-14-28)22-40-32(20-31(39-40)27-8-5-17-37-21-27)25-6-4-7-26(19-25)33(42)38-34(43)30(36)18-23-11-15-29(41)16-12-23/h4-17,19-21,30,41H,18,22,36H2,1-3H3,(H,38,42,43)