1-cyclopentyl-N-[(2S,3R)-3-hydroxy-1-phenyl-4-{[3-(trifluoromethyl)benzyl]amino}butan-2-yl]-6-oxo-5-(2-oxopyrrolidin-1-yl)-1,6-dihydropyridine-3-carboxamide (Q27452359)

CHEMBL2407494 (English)

19 October 2016

chemical formula

C₃₃H₃₇F₃N₄O₄

1 reference

CHEMBL2407494 (English)

19 October 2016

canonical SMILES

C1CCC(C1)N2C=C(C=C(C2=O)N3CCCC3=O)C(=O)NC(CC4=CC=CC=C4)C(CNCC5=CC(=CC=C5)C(F)(F)F)O

1 reference

CHEMBL2407494 (English)

19 October 2016

isomeric SMILES

C1CCC(C1)N2C=C(C=C(C2=O)N3CCCC3=O)C(=O)N[C@@H](CC4=CC=CC=C4)[C@@H](CNCC5=CC(=CC=C5)C(F)(F)F)O

1 reference

CHEMBL2407494 (English)

InChI=1S/C33H37F3N4O4/c34-33(35,36)25-11-6-10-23(16-25)19-37-20-29(41)27(17-22-8-2-1-3-9-22)38-31(43)24-18-28(39-15-7-14-30(39)42)32(44)40(21-24)26-12-4-5-13-26/h1-3,6,8-11,16,18,21,26-27,29,37,41H,4-5,7,12-15,17,19-20H2,(H,38,43)/t27-,29+/m0/s1

19 October 2016

Identifiers

InChI

1 reference

CHEMBL2407494 (English)

QKLJNYJRYSKKKP-LMSSTIIKSA-N

19 October 2016

InChIKey

1 reference

CHEMBL2407494 (English)

19 October 2016

1 reference

1-Cyclopentyl-N-[(2S,3R)-3-hydroxy-1-phenyl-4-{[3-(trifluoromethyl)benzyl]amino}-2-butanyl]-6-oxo-5-(2-oxo-1-pyrrolidinyl)-1,6-dihydro-3-pyridinecarboxamide (English)

19 October 2016

1 reference