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

Systemtic Name: 3-[1-(1-butyl-2-methyl-indol-3-yl)ethyl]-6-(pyridin-2-ylmethyl)piperazine-2,5-dione Openeye Name: 3-[1-(1-butyl-2-methyl-indol-3-yl)ethyl]-6-(2-pyridylmethyl)piperazine-2,5-dione CAS Name: 3-[1-(1-butyl-2-methyl-3-indolyl)ethyl]-6-(2-pyridinylmethyl)piperazine-2,5-dione IUPAC Name: 3-[1-(1-butyl-2-methylindol-3-yl)ethyl]-6-(pyridin-2-ylmethyl)piperazine-2,5-dione Traditional Name: 3-[1-(1-butyl-2-methyl-indol-3-yl)ethyl]-6-(2-pyridylmethyl)piperazine-2,5-quinone Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=CC=CC=C21)C(C)C3C(=O)NC(C(=O)N3)CC4=CC=CC=N4)C

Isomeric SMILES

CCCCN1C(=C(C2=CC=CC=C21)C(C)C3C(=O)NC(C(=O)N3)CC4=CC=CC=N4)C

InChI

InChI=1S/C25H30N4O2/c1-4-5-14-29-17(3)22(19-11-6-7-12-21(19)29)16(2)23-25(31)27-20(24(30)28-23)15-18-10-8-9-13-26-18/h6-13,16,20,23H,4-5,14-15H2,1-3H3,(H,27,31)(H,28,30)