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

Systemtic Name: N-[(2S)-1-azanyl-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-5-[2-(4-tert-butylphenyl)-5-pyridin-3-yl-pyrazol-3-yl]pentanamide Openeye Name: N-[(1S)-2-amino-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]-5-[2-(4-tert-butylphenyl)-5-(3-pyridyl)pyrazol-3-yl]pentanamide CAS Name: N-[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-5-[2-(4-tert-butylphenyl)-5-(3-pyridinyl)-3-pyrazolyl]pentanamide IUPAC Name: N-[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-5-[2-(4-tert-butylphenyl)-5-pyridin-3-ylpyrazol-3-yl]pentanamide Traditional Name: N-[(1S)-2-amino-1-(4-hydroxybenzyl)-2-keto-ethyl]-5-[2-(4-tert-butylphenyl)-5-(3-pyridyl)pyrazol-3-yl]valeramide Formula: C32H37N5O3 MolecularWeight: 539.66788

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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)CCCCC(=O)NC(CC4=CC=C(C=C4)O)C(=O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=CC(=N2)C3=CN=CC=C3)CCCCC(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)N

InChI

InChI=1S/C32H37N5O3/c1-32(2,3)24-12-14-25(15-13-24)37-26(20-28(36-37)23-7-6-18-34-21-23)8-4-5-9-30(39)35-29(31(33)40)19-22-10-16-27(38)17-11-22/h6-7,10-18,20-21,29,38H,4-5,8-9,19H2,1-3H3,(H2,33,40)(H,35,39)/t29-/m0/s1