1-(5-bromanylpyridin-2-yl)-3-[(2S)-2-(6-fluoranyl-2-oxidanyl-3-propanoyl-phenyl)cyclopropyl]urea

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-3-[(2S)-2-(6-fluoranyl-2-oxidanyl-3-propanoyl-phenyl)cyclopropyl]urea Openeye Name: 1-(5-bromo-2-pyridyl)-3-[(2S)-2-(6-fluoro-2-hydroxy-3-propanoyl-phenyl)cyclopropyl]urea CAS Name: 1-(5-bromo-2-pyridinyl)-3-[(2S)-2-[6-fluoro-2-hydroxy-3-(1-oxopropyl)phenyl]cyclopropyl]urea IUPAC Name: 1-(5-bromopyridin-2-yl)-3-[(2S)-2-(6-fluoro-2-hydroxy-3-propanoylphenyl)cyclopropyl]urea Traditional Name: 1-(5-bromo-2-pyridyl)-3-[(2S)-2-(6-fluoro-2-hydroxy-3-propionyl-phenyl)cyclopropyl]urea Formula: C18H17BrFN3O3 MolecularWeight: 422.248283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C(=C(C=C1)F)C2CC2NC(=O)NC3=NC=C(C=C3)Br)O

Isomeric SMILES

CCC(=O)C1=C(C(=C(C=C1)F)[C@@H]2CC2NC(=O)NC3=NC=C(C=C3)Br)O

InChI

InChI=1S/C18H17BrFN3O3/c1-2-14(24)10-4-5-12(20)16(17(10)25)11-7-13(11)22-18(26)23-15-6-3-9(19)8-21-15/h3-6,8,11,13,25H,2,7H2,1H3,(H2,21,22,23,26)/t11-,13?/m1/s1