2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]ethanamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-(1,3-dioxo-4H-isoquinolin-2-yl)acetamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2-(1,3-dioxo-4H-isoquinolin-2-yl)acetamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2-(1,3-dioxo-4H-isoquinolin-2-yl)acetamide Traditional Name: 2-(1,3-diketo-4H-isoquinolin-2-yl)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]acetamide Formula: C23H22N4O3 MolecularWeight: 402.44578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CN3C(=O)CC4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)CN3C(=O)CC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H22N4O3/c1-15-20(16(2)27(25-15)18-9-4-3-5-10-18)13-24-21(28)14-26-22(29)12-17-8-6-7-11-19(17)23(26)30/h3-11H,12-14H2,1-2H3,(H,24,28)