2-(3-oxidanylidene-4H-1,4-benzoxazin-2-yl)-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]ethanamide

Systemtic Name: 2-(3-oxidanylidene-4H-1,4-benzoxazin-2-yl)-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]ethanamide Openeye Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetamide CAS Name: 2-(3-oxo-4H-1,4-benzoxazin-2-yl)-N-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]acetamide IUPAC Name: N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetamide Traditional Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-2-(3-keto-4H-1,4-benzoxazin-2-yl)acetamide Formula: C27H24N4O3 MolecularWeight: 452.50446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)CNC(=O)CC4C(=O)NC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)CNC(=O)CC4C(=O)NC5=CC=CC=C5O4

InChI

InChI=1S/C27H24N4O3/c32-25(15-24-27(33)29-22-13-7-8-14-23(22)34-24)28-16-21-18-31(17-19-9-3-1-4-10-19)30-26(21)20-11-5-2-6-12-20/h1-14,18,24H,15-17H2,(H,28,32)(H,29,33)