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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C1=O)NC2=CC3=C(C=C2)NC=C3CCCN4CCNC(C4)C5=CC=CC=N5

Isomeric SMILES

CC1=C(C(=O)C1=O)NC2=CC3=C(C=C2)NC=C3CCCN4CCNC(C4)C5=CC=CC=N5

InChI

InChI=1S/C25H27N5O2/c1-16-23(25(32)24(16)31)29-18-7-8-20-19(13-18)17(14-28-20)5-4-11-30-12-10-27-22(15-30)21-6-2-3-9-26-21/h2-3,6-9,13-14,22,27-29H,4-5,10-12,15H2,1H3