N-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-5-methyl-4-[(3-methylphenoxy)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-5-methyl-4-[(3-methylphenoxy)methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-5-methyl-4-[(3-methylphenoxy)methyl]isoxazole-3-carboxamide CAS Name: N-[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)ethyl]-5-methyl-4-[(3-methylphenoxy)methyl]-3-isoxazolecarboxamide IUPAC Name: N-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-5-methyl-4-[(3-methylphenoxy)methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-5-methyl-4-[(3-methylphenoxy)methyl]isoxazole-3-carboxamide Formula: C20H23BrN4O3 MolecularWeight: 447.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=C(ON=C2C(=O)NCCN3C(=C(C(=N3)C)Br)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=C(ON=C2C(=O)NCCN3C(=C(C(=N3)C)Br)C)C

InChI

InChI=1S/C20H23BrN4O3/c1-12-6-5-7-16(10-12)27-11-17-15(4)28-24-19(17)20(26)22-8-9-25-14(3)18(21)13(2)23-25/h5-7,10H,8-9,11H2,1-4H3,(H,22,26)