N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-5-methyl-4-[(3-methylphenoxy)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-5-methyl-4-[(3-methylphenoxy)methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-5-methyl-4-[(3-methylphenoxy)methyl]isoxazole-3-carboxamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-5-methyl-4-[(3-methylphenoxy)methyl]-3-isoxazolecarboxamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-5-methyl-4-[(3-methylphenoxy)methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-5-methyl-4-[(3-methylphenoxy)methyl]isoxazole-3-carboxamide Formula: C23H21BrN4O3 MolecularWeight: 481.34184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=C(ON=C2C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Br)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=C(ON=C2C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Br)C

InChI

InChI=1S/C23H21BrN4O3/c1-15-5-3-8-20(9-15)30-14-21-16(2)31-27-22(21)23(29)26-19-7-4-6-17(10-19)12-28-13-18(24)11-25-28/h3-11,13H,12,14H2,1-2H3,(H,26,29)