N-(cyclopropylmethyl)-5-[[(4-fluorophenyl)carbonyl-pentan-3-yl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-5-[[(4-fluorophenyl)carbonyl-pentan-3-yl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(cyclopropylmethyl)-5-[[1-ethylpropyl-(4-fluorobenzoyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(cyclopropylmethyl)-5-[[[(4-fluorophenyl)-oxomethyl]-pentan-3-ylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(cyclopropylmethyl)-5-[[(4-fluorobenzoyl)-pentan-3-ylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-(cyclopropylmethyl)-5-[[1-ethylpropyl-(4-fluorobenzoyl)amino]methyl]isoxazole-3-carboxamide Formula: C21H26FN3O3 MolecularWeight: 387.447843

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N(CC1=CC(=NO1)C(=O)NCC2CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(CC)N(CC1=CC(=NO1)C(=O)NCC2CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3O3/c1-3-17(4-2)25(21(27)15-7-9-16(22)10-8-15)13-18-11-19(24-28-18)20(26)23-12-14-5-6-14/h7-11,14,17H,3-6,12-13H2,1-2H3,(H,23,26)