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

Systemtic Name: 2-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]ethanamide Openeye Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetamide CAS Name: 2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]acetamide IUPAC Name: N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetamide Traditional Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-2-[(2S)-3-keto-2-methyl-1,4-benzoxazin-4-yl]acetamide Formula: C28H26N4O3 MolecularWeight: 466.53104

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CC(=O)NCC3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C[C@H]1C(=O)N(C2=CC=CC=C2O1)CC(=O)NCC3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C28H26N4O3/c1-20-28(34)32(24-14-8-9-15-25(24)35-20)19-26(33)29-16-23-18-31(17-21-10-4-2-5-11-21)30-27(23)22-12-6-3-7-13-22/h2-15,18,20H,16-17,19H2,1H3,(H,29,33)/t20-/m0/s1