5-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-N-[(1R)-1-pyridin-4-ylpropyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-N-[(1R)-1-pyridin-4-ylpropyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-N-[(1R)-1-(4-pyridyl)propyl]isoxazole-3-carboxamide CAS Name: 5-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-[(1R)-1-pyridin-4-ylpropyl]-3-isoxazolecarboxamide IUPAC Name: 5-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-[(1R)-1-pyridin-4-ylpropyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-N-[(1R)-1-(4-pyridyl)propyl]isoxazole-3-carboxamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=NC=C1)NC(=O)C2=NOC(=C2)COC3=CC(=C(C(=C3)C)Cl)C

Isomeric SMILES

CC[C@H](C1=CC=NC=C1)NC(=O)C2=NOC(=C2)COC3=CC(=C(C(=C3)C)Cl)C

InChI

InChI=1S/C21H22ClN3O3/c1-4-18(15-5-7-23-8-6-15)24-21(26)19-11-17(28-25-19)12-27-16-9-13(2)20(22)14(3)10-16/h5-11,18H,4,12H2,1-3H3,(H,24,26)/t18-/m1/s1