3-[1-(5-bromanyl-1-ethyl-indol-3-yl)ethyl]-6-(pyridin-2-ylmethyl)piperazine-2,5-dione

Systemtic Name: 3-[1-(5-bromanyl-1-ethyl-indol-3-yl)ethyl]-6-(pyridin-2-ylmethyl)piperazine-2,5-dione Openeye Name: 3-[1-(5-bromo-1-ethyl-indol-3-yl)ethyl]-6-(2-pyridylmethyl)piperazine-2,5-dione CAS Name: 3-[1-(5-bromo-1-ethyl-3-indolyl)ethyl]-6-(2-pyridinylmethyl)piperazine-2,5-dione IUPAC Name: 3-[1-(5-bromo-1-ethylindol-3-yl)ethyl]-6-(pyridin-2-ylmethyl)piperazine-2,5-dione Traditional Name: 3-[1-(5-bromo-1-ethyl-indol-3-yl)ethyl]-6-(2-pyridylmethyl)piperazine-2,5-quinone Formula: C22H23BrN4O2 MolecularWeight: 455.34762

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C=CC(=C2)Br)C(C)C3C(=O)NC(C(=O)N3)CC4=CC=CC=N4

Isomeric SMILES

CCN1C=C(C2=C1C=CC(=C2)Br)C(C)C3C(=O)NC(C(=O)N3)CC4=CC=CC=N4

InChI

InChI=1S/C22H23BrN4O2/c1-3-27-12-17(16-10-14(23)7-8-19(16)27)13(2)20-22(29)25-18(21(28)26-20)11-15-6-4-5-9-24-15/h4-10,12-13,18,20H,3,11H2,1-2H3,(H,25,29)(H,26,28)