4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]methylidene]-2-phenyl-isoquinoline-1,3-dione

Systemtic Name: 4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]methylidene]-2-phenyl-isoquinoline-1,3-dione Openeye Name: 4-[[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]methylene]-2-phenyl-isoquinoline-1,3-dione CAS Name: 4-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]methylidene]-2-phenylisoquinoline-1,3-dione IUPAC Name: 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]methylidene]-2-phenylisoquinoline-1,3-dione Traditional Name: 4-[[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]methylene]-2-phenyl-isoquinoline-1,3-quinone Formula: C27H22N4O3 MolecularWeight: 450.48858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C4=CC=CC=C4C(=O)N(C3=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C4=CC=CC=C4C(=O)N(C3=O)C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O3/c1-18-24(27(34)31(29(18)2)20-13-7-4-8-14-20)28-17-23-21-15-9-10-16-22(21)25(32)30(26(23)33)19-11-5-3-6-12-19/h3-17,28H,1-2H3