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

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-3-[(1S,2S)-2-(6-fluoranyl-2-methoxy-3-propanoyl-phenyl)cyclopropyl]urea Openeye Name: 1-(5-bromo-2-pyridyl)-3-[(1S,2S)-2-(6-fluoro-2-methoxy-3-propanoyl-phenyl)cyclopropyl]urea CAS Name: 1-(5-bromo-2-pyridinyl)-3-[(1S,2S)-2-[6-fluoro-2-methoxy-3-(1-oxopropyl)phenyl]cyclopropyl]urea IUPAC Name: 1-(5-bromopyridin-2-yl)-3-[(1S,2S)-2-(6-fluoro-2-methoxy-3-propanoylphenyl)cyclopropyl]urea Traditional Name: 1-(5-bromo-2-pyridyl)-3-[(1S,2S)-2-(6-fluoro-2-methoxy-3-propionyl-phenyl)cyclopropyl]urea Formula: C19H19BrFN3O3 MolecularWeight: 436.274863

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrFN3O3/c1-3-15(25)11-5-6-13(21)17(18(11)27-2)12-8-14(12)23-19(26)24-16-7-4-10(20)9-22-16/h4-7,9,12,14H,3,8H2,1-2H3,(H2,22,23,24,26)/t12-,14+/m1/s1