2-[4-[4-(5-methylpyrazin-2-yl)imidazol-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(5-methylpyrazin-2-yl)imidazol-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(5-methylpyrazin-2-yl)imidazol-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(5-methyl-2-pyrazinyl)-1-imidazolyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(5-methylpyrazin-2-yl)imidazol-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(5-methylpyrazin-2-yl)imidazol-1-yl]butyl]isoindoline-1,3-quinone Formula: C20H19N5O2 MolecularWeight: 361.39716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C2=CN(C=N2)CCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=NC=C(N=C1)C2=CN(C=N2)CCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H19N5O2/c1-14-10-22-17(11-21-14)18-12-24(13-23-18)8-4-5-9-25-19(26)15-6-2-3-7-16(15)20(25)27/h2-3,6-7,10-13H,4-5,8-9H2,1H3