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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)CC2=CC(=C(C=C2)F)NC(=O)NC3=NC=CO3

Isomeric SMILES

COC(=O)N1CCN(CC1)CC2=CC(=C(C=C2)F)NC(=O)NC3=NC=CO3

InChI

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