methyl 4-[[3-fluoranyl-5-(1,2-oxazol-3-ylcarbamoylamino)phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[[3-fluoranyl-5-(1,2-oxazol-3-ylcarbamoylamino)phenyl]methyl]piperazine-1-carboxylate Openeye Name: methyl 4-[[3-fluoro-5-(isoxazol-3-ylcarbamoylamino)phenyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-fluoro-5-[[(3-isoxazolylamino)-oxomethyl]amino]phenyl]methyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[[3-fluoro-5-(1,2-oxazol-3-ylcarbamoylamino)phenyl]methyl]piperazine-1-carboxylate Traditional Name: 4-[3-fluoro-5-(isoxazol-3-ylcarbamoylamino)benzyl]piperazine-1-carboxylic acid methyl ester Formula: C17H20FN5O4 MolecularWeight: 377.370203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)CC2=CC(=CC(=C2)F)NC(=O)NC3=NOC=C3

Isomeric SMILES

COC(=O)N1CCN(CC1)CC2=CC(=CC(=C2)F)NC(=O)NC3=NOC=C3

InChI

InChI=1S/C17H20FN5O4/c1-26-17(25)23-5-3-22(4-6-23)11-12-8-13(18)10-14(9-12)19-16(24)20-15-2-7-27-21-15/h2,7-10H,3-6,11H2,1H3,(H2,19,20,21,24)