N-(4-bromanyl-3-methyl-phenyl)-3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide CAS Name: N-(4-bromo-3-methylphenyl)-3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-(3-p-phenetyl-1,2,4-oxadiazol-5-yl)propionamide Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)NC3=CC(=C(C=C3)Br)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)NC3=CC(=C(C=C3)Br)C

InChI

InChI=1S/C20H20BrN3O3/c1-3-26-16-7-4-14(5-8-16)20-23-19(27-24-20)11-10-18(25)22-15-6-9-17(21)13(2)12-15/h4-9,12H,3,10-11H2,1-2H3,(H,22,25)