3-methyl-4-[[3-[1-(4-pyridin-2-ylpiperazin-1-yl)propyl]-1H-indol-5-yl]amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-methyl-4-[[3-[1-(4-pyridin-2-ylpiperazin-1-yl)propyl]-1H-indol-5-yl]amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-methyl-4-[[3-[1-[4-(2-pyridyl)piperazin-1-yl]propyl]-1H-indol-5-yl]amino]cyclobut-3-ene-1,2-dione CAS Name: 3-methyl-4-[[3-[1-[4-(2-pyridinyl)-1-piperazinyl]propyl]-1H-indol-5-yl]amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-methyl-4-[[3-[1-(4-pyridin-2-ylpiperazin-1-yl)propyl]-1H-indol-5-yl]amino]cyclobut-3-ene-1,2-dione Traditional Name: 3-methyl-4-[[3-[1-[4-(2-pyridyl)piperazino]propyl]-1H-indol-5-yl]amino]cyclobut-3-ene-1,2-quinone Formula: C25H27N5O2 MolecularWeight: 429.51418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CNC2=C1C=C(C=C2)NC3=C(C(=O)C3=O)C)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CCC(C1=CNC2=C1C=C(C=C2)NC3=C(C(=O)C3=O)C)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C25H27N5O2/c1-3-21(29-10-12-30(13-11-29)22-6-4-5-9-26-22)19-15-27-20-8-7-17(14-18(19)20)28-23-16(2)24(31)25(23)32/h4-9,14-15,21,27-28H,3,10-13H2,1-2H3