methyl 2-[[[3,5-bis(trifluoromethyl)phenyl]carbamoyl-pentyl-amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[[3,5-bis(trifluoromethyl)phenyl]carbamoyl-pentyl-amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[[3,5-bis(trifluoromethyl)phenyl]carbamoyl-pentyl-amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[[3,5-bis(trifluoromethyl)anilino]-oxomethyl]-pentylamino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[[3,5-bis(trifluoromethyl)phenyl]carbamoyl-pentylamino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[amyl-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C20H21F6N3O4 MolecularWeight: 481.388859

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=NC(=CO1)C(=O)OC)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCCCN(CC1=NC(=CO1)C(=O)OC)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C20H21F6N3O4/c1-3-4-5-6-29(10-16-28-15(11-33-16)17(30)32-2)18(31)27-14-8-12(19(21,22)23)7-13(9-14)20(24,25)26/h7-9,11H,3-6,10H2,1-2H3,(H,27,31)