2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-3-phenyl-propanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-3-phenyl-propanamide Openeye Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanamide CAS Name: N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-2-(1,3-dioxo-2-isoindolyl)-3-phenylpropanamide IUPAC Name: N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide Traditional Name: N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-3-phenyl-2-phthalimido-propionamide Formula: C30H20N6O3 MolecularWeight: 512.5182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C=C3)C#N)N5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2=C(C=NN2C3=NC4=CC=CC=C4C=C3)C#N)N5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C30H20N6O3/c31-17-21-18-32-36(26-15-14-20-10-4-7-13-24(20)33-26)27(21)34-28(37)25(16-19-8-2-1-3-9-19)35-29(38)22-11-5-6-12-23(22)30(35)39/h1-15,18,25H,16H2,(H,34,37)