3-(4-pyrazin-2-ylpiperazin-1-yl)carbonyl-1,6,7,8-tetrahydroquinoline-2,5-dione

Systemtic Name: 3-(4-pyrazin-2-ylpiperazin-1-yl)carbonyl-1,6,7,8-tetrahydroquinoline-2,5-dione Openeye Name: 3-(4-pyrazin-2-ylpiperazine-1-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione CAS Name: 3-[oxo-[4-(2-pyrazinyl)-1-piperazinyl]methyl]-1,6,7,8-tetrahydroquinoline-2,5-dione IUPAC Name: 3-(4-pyrazin-2-ylpiperazine-1-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-dione Traditional Name: 3-(4-pyrazin-2-ylpiperazine-1-carbonyl)-1,6,7,8-tetrahydroquinoline-2,5-quinone Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C(=O)N2)C(=O)N3CCN(CC3)C4=NC=CN=C4)C(=O)C1

Isomeric SMILES

C1CC2=C(C=C(C(=O)N2)C(=O)N3CCN(CC3)C4=NC=CN=C4)C(=O)C1

InChI

InChI=1S/C18H19N5O3/c24-15-3-1-2-14-12(15)10-13(17(25)21-14)18(26)23-8-6-22(7-9-23)16-11-19-4-5-20-16/h4-5,10-11H,1-3,6-9H2,(H,21,25)