3-methylidene-2-[1-oxidanylidene-1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-yl]isoindol-1-one

Systemtic Name: 3-methylidene-2-[1-oxidanylidene-1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-yl]isoindol-1-one Openeye Name: 3-methylene-2-[1-methyl-2-oxo-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]isoindolin-1-one CAS Name: 3-methylene-2-[1-oxo-1-[4-(2-pyrazinyl)-1-piperazinyl]propan-2-yl]-1-isoindolone IUPAC Name: 3-methylidene-2-[1-oxo-1-(4-pyrazin-2-ylpiperazin-1-yl)propan-2-yl]isoindol-1-one Traditional Name: 2-[2-keto-1-methyl-2-(4-pyrazin-2-ylpiperazino)ethyl]-3-methylene-isoindolin-1-one Formula: C20H21N5O2 MolecularWeight: 363.41304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=NC=CN=C2)N3C(=C)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=NC=CN=C2)N3C(=C)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H21N5O2/c1-14-16-5-3-4-6-17(16)20(27)25(14)15(2)19(26)24-11-9-23(10-12-24)18-13-21-7-8-22-18/h3-8,13,15H,1,9-12H2,2H3