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

Systemtic Name: 1-(5-cyanopyridin-2-yl)-3-[(1S,2S)-2-(6-fluoranyl-2-methoxy-3-propanoyl-phenyl)cyclopropyl]urea Openeye Name: 1-(5-cyano-2-pyridyl)-3-[(1S,2S)-2-(6-fluoro-2-methoxy-3-propanoyl-phenyl)cyclopropyl]urea CAS Name: 1-(5-cyano-2-pyridinyl)-3-[(1S,2S)-2-[6-fluoro-2-methoxy-3-(1-oxopropyl)phenyl]cyclopropyl]urea IUPAC Name: 1-(5-cyanopyridin-2-yl)-3-[(1S,2S)-2-(6-fluoro-2-methoxy-3-propanoylphenyl)cyclopropyl]urea Traditional Name: 1-(5-cyano-2-pyridyl)-3-[(1S,2S)-2-(6-fluoro-2-methoxy-3-propionyl-phenyl)cyclopropyl]urea Formula: C20H19FN4O3 MolecularWeight: 382.388263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19FN4O3/c1-3-16(26)12-5-6-14(21)18(19(12)28-2)13-8-15(13)24-20(27)25-17-7-4-11(9-22)10-23-17/h4-7,10,13,15H,3,8H2,1-2H3,(H2,23,24,25,27)/t13-,15+/m1/s1