2-[4-(4-pyrazin-2-ylimidazol-1-yl)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(4-pyrazin-2-ylimidazol-1-yl)butyl]isoindole-1,3-dione Openeye Name: 2-[4-(4-pyrazin-2-ylimidazol-1-yl)butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(2-pyrazinyl)-1-imidazolyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4-pyrazin-2-ylimidazol-1-yl)butyl]isoindole-1,3-dione Traditional Name: 2-[4-(4-pyrazin-2-ylimidazol-1-yl)butyl]isoindoline-1,3-quinone Formula: C19H17N5O2 MolecularWeight: 347.37058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCN3C=C(N=C3)C4=NC=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCN3C=C(N=C3)C4=NC=CN=C4

InChI

InChI=1S/C19H17N5O2/c25-18-14-5-1-2-6-15(14)19(26)24(18)10-4-3-9-23-12-17(22-13-23)16-11-20-7-8-21-16/h1-2,5-8,11-13H,3-4,9-10H2