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

Systemtic Name: 3-[1-(1-butyl-5-fluoranyl-indol-3-yl)ethyl]-6-(pyridin-2-ylmethyl)piperazine-2,5-dione Openeye Name: 3-[1-(1-butyl-5-fluoro-indol-3-yl)ethyl]-6-(2-pyridylmethyl)piperazine-2,5-dione CAS Name: 3-[1-(1-butyl-5-fluoro-3-indolyl)ethyl]-6-(2-pyridinylmethyl)piperazine-2,5-dione IUPAC Name: 3-[1-(1-butyl-5-fluoroindol-3-yl)ethyl]-6-(pyridin-2-ylmethyl)piperazine-2,5-dione Traditional Name: 3-[1-(1-butyl-5-fluoro-indol-3-yl)ethyl]-6-(2-pyridylmethyl)piperazine-2,5-quinone Formula: C24H27FN4O2 MolecularWeight: 422.495183

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C2=C1C=CC(=C2)F)C(C)C3C(=O)NC(C(=O)N3)CC4=CC=CC=N4

Isomeric SMILES

CCCCN1C=C(C2=C1C=CC(=C2)F)C(C)C3C(=O)NC(C(=O)N3)CC4=CC=CC=N4

InChI

InChI=1S/C24H27FN4O2/c1-3-4-11-29-14-19(18-12-16(25)8-9-21(18)29)15(2)22-24(31)27-20(23(30)28-22)13-17-7-5-6-10-26-17/h5-10,12,14-15,20,22H,3-4,11,13H2,1-2H3,(H,27,31)(H,28,30)