N-[1-azanyl-3-(3-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-6-[2-(4-tert-butylphenyl)-5-pyridin-2-yl-pyrazol-3-yl]hexanamide

Systemtic Name: N-[1-azanyl-3-(3-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-6-[2-(4-tert-butylphenyl)-5-pyridin-2-yl-pyrazol-3-yl]hexanamide Openeye Name: N-[2-amino-1-[(3-hydroxyphenyl)methyl]-2-oxo-ethyl]-6-[2-(4-tert-butylphenyl)-5-(2-pyridyl)pyrazol-3-yl]hexanamide CAS Name: N-[1-amino-3-(3-hydroxyphenyl)-1-oxopropan-2-yl]-6-[2-(4-tert-butylphenyl)-5-(2-pyridinyl)-3-pyrazolyl]hexanamide IUPAC Name: N-[1-amino-3-(3-hydroxyphenyl)-1-oxopropan-2-yl]-6-[2-(4-tert-butylphenyl)-5-pyridin-2-ylpyrazol-3-yl]hexanamide Traditional Name: N-[2-amino-1-(3-hydroxybenzyl)-2-keto-ethyl]-6-[2-(4-tert-butylphenyl)-5-(2-pyridyl)pyrazol-3-yl]hexanamide Formula: C33H39N5O3 MolecularWeight: 553.69446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=N3)CCCCCC(=O)NC(CC4=CC(=CC=C4)O)C(=O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=N3)CCCCCC(=O)NC(CC4=CC(=CC=C4)O)C(=O)N

InChI

InChI=1S/C33H39N5O3/c1-33(2,3)24-15-17-25(18-16-24)38-26(22-29(37-38)28-13-7-8-19-35-28)11-5-4-6-14-31(40)36-30(32(34)41)21-23-10-9-12-27(39)20-23/h7-10,12-13,15-20,22,30,39H,4-6,11,14,21H2,1-3H3,(H2,34,41)(H,36,40)