2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]ethanamide

Systemtic Name: 2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]ethanamide Openeye Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]acetamide CAS Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]acetamide IUPAC Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]acetamide Traditional Name: 2-(7-bromo-3-keto-1,4-benzoxazin-4-yl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]acetamide Formula: C22H21BrN4O3 MolecularWeight: 469.33114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

InChI

InChI=1S/C22H21BrN4O3/c1-14-18(15(2)27(25-14)17-6-4-3-5-7-17)11-24-21(28)12-26-19-9-8-16(23)10-20(19)30-13-22(26)29/h3-10H,11-13H2,1-2H3,(H,24,28)