1-[2-(3-butanoyl-6-fluoranyl-2-oxidanyl-phenyl)cyclopropyl]-3-(5-cyanopyridin-2-yl)urea

Systemtic Name: 1-[2-(3-butanoyl-6-fluoranyl-2-oxidanyl-phenyl)cyclopropyl]-3-(5-cyanopyridin-2-yl)urea Openeye Name: 1-[2-(3-butanoyl-6-fluoro-2-hydroxy-phenyl)cyclopropyl]-3-(5-cyano-2-pyridyl)urea CAS Name: 1-(5-cyano-2-pyridinyl)-3-[2-[6-fluoro-2-hydroxy-3-(1-oxobutyl)phenyl]cyclopropyl]urea IUPAC Name: 1-[2-(3-butanoyl-6-fluoro-2-hydroxyphenyl)cyclopropyl]-3-(5-cyanopyridin-2-yl)urea Traditional Name: 1-[2-(3-butyryl-6-fluoro-2-hydroxy-phenyl)cyclopropyl]-3-(5-cyano-2-pyridyl)urea Formula: C20H19FN4O3 MolecularWeight: 382.388263

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C(=C(C=C1)F)C2CC2NC(=O)NC3=NC=C(C=C3)C#N)O

Isomeric SMILES

CCCC(=O)C1=C(C(=C(C=C1)F)C2CC2NC(=O)NC3=NC=C(C=C3)C#N)O

InChI

InChI=1S/C20H19FN4O3/c1-2-3-16(26)12-5-6-14(21)18(19(12)27)13-8-15(13)24-20(28)25-17-7-4-11(9-22)10-23-17/h4-7,10,13,15,27H,2-3,8H2,1H3,(H2,23,24,25,28)