3-(cyclopropylamino)-4-[4-(8-pyridin-4-ylquinolin-2-yl)piperazin-1-yl]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(cyclopropylamino)-4-[4-(8-pyridin-4-ylquinolin-2-yl)piperazin-1-yl]cyclobut-3-ene-1,2-dione Openeye Name: 3-(cyclopropylamino)-4-[4-[8-(4-pyridyl)-2-quinolyl]piperazin-1-yl]cyclobut-3-ene-1,2-dione CAS Name: 3-(cyclopropylamino)-4-[4-(8-pyridin-4-yl-2-quinolinyl)-1-piperazinyl]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(cyclopropylamino)-4-[4-(8-pyridin-4-ylquinolin-2-yl)piperazin-1-yl]cyclobut-3-ene-1,2-dione Traditional Name: 3-(cyclopropylamino)-4-[4-[8-(4-pyridyl)-2-quinolyl]piperazino]cyclobut-3-ene-1,2-quinone Formula: C25H23N5O2 MolecularWeight: 425.48242

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C(=O)C2=O)N3CCN(CC3)C4=NC5=C(C=CC=C5C6=CC=NC=C6)C=C4

Isomeric SMILES

C1CC1NC2=C(C(=O)C2=O)N3CCN(CC3)C4=NC5=C(C=CC=C5C6=CC=NC=C6)C=C4

InChI

InChI=1S/C25H23N5O2/c31-24-22(27-18-5-6-18)23(25(24)32)30-14-12-29(13-15-30)20-7-4-17-2-1-3-19(21(17)28-20)16-8-10-26-11-9-16/h1-4,7-11,18,27H,5-6,12-15H2