N-[1-azanyl-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-5-(2-butyl-5-quinolin-6-yl-pyrazol-3-yl)pentanamide

Systemtic Name: N-[1-azanyl-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-5-(2-butyl-5-quinolin-6-yl-pyrazol-3-yl)pentanamide Openeye Name: N-[2-amino-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]-5-[2-butyl-5-(6-quinolyl)pyrazol-3-yl]pentanamide CAS Name: N-[1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-5-[2-butyl-5-(6-quinolinyl)-3-pyrazolyl]pentanamide IUPAC Name: N-[1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-5-(2-butyl-5-quinolin-6-ylpyrazol-3-yl)pentanamide Traditional Name: N-[2-amino-1-(4-hydroxybenzyl)-2-keto-ethyl]-5-[2-butyl-5-(6-quinolyl)pyrazol-3-yl]valeramide Formula: C30H35N5O3 MolecularWeight: 513.6306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=N1)C2=CC3=C(C=C2)N=CC=C3)CCCCC(=O)NC(CC4=CC=C(C=C4)O)C(=O)N

Isomeric SMILES

CCCCN1C(=CC(=N1)C2=CC3=C(C=C2)N=CC=C3)CCCCC(=O)NC(CC4=CC=C(C=C4)O)C(=O)N

InChI

InChI=1S/C30H35N5O3/c1-2-3-17-35-24(20-27(34-35)23-12-15-26-22(19-23)7-6-16-32-26)8-4-5-9-29(37)33-28(30(31)38)18-21-10-13-25(36)14-11-21/h6-7,10-16,19-20,28,36H,2-5,8-9,17-18H2,1H3,(H2,31,38)(H,33,37)