3-(1H-indol-3-yl)-4-[5-(4-methylpiperazin-1-yl)pyridin-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-(1H-indol-3-yl)-4-[5-(4-methylpiperazin-1-yl)pyridin-3-yl]pyrrole-2,5-dione Openeye Name: 3-(1H-indol-3-yl)-4-[5-(4-methylpiperazin-1-yl)-3-pyridyl]pyrrole-2,5-dione CAS Name: 3-(1H-indol-3-yl)-4-[5-(4-methyl-1-piperazinyl)-3-pyridinyl]pyrrole-2,5-dione IUPAC Name: 3-(1H-indol-3-yl)-4-[5-(4-methylpiperazin-1-yl)pyridin-3-yl]pyrrole-2,5-dione Traditional Name: 3-(1H-indol-3-yl)-4-[5-(4-methylpiperazino)-3-pyridyl]-3-pyrroline-2,5-quinone Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CN=CC(=C2)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

CN1CCN(CC1)C2=CN=CC(=C2)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C22H21N5O2/c1-26-6-8-27(9-7-26)15-10-14(11-23-12-15)19-20(22(29)25-21(19)28)17-13-24-18-5-3-2-4-16(17)18/h2-5,10-13,24H,6-9H2,1H3,(H,25,28,29)