3-azanyl-4-[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-azanyl-4-[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]cyclobut-3-ene-1,2-dione Openeye Name: 3-amino-4-[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]cyclobut-3-ene-1,2-dione CAS Name: 3-amino-4-[3-[3-[4-(5-methoxy-4-pyrimidinyl)-1-piperazinyl]propyl]-1H-indol-5-yl]cyclobut-3-ene-1,2-dione IUPAC Name: 3-amino-4-[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]cyclobut-3-ene-1,2-dione Traditional Name: 3-amino-4-[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazino]propyl]-1H-indol-5-yl]cyclobut-3-ene-1,2-quinone Formula: C24H26N6O3 MolecularWeight: 446.50164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=CN=C1N2CCN(CC2)CCCC3=CNC4=C3C=C(C=C4)C5=C(C(=O)C5=O)N

Isomeric SMILES

COC1=CN=CN=C1N2CCN(CC2)CCCC3=CNC4=C3C=C(C=C4)C5=C(C(=O)C5=O)N

InChI

InChI=1S/C24H26N6O3/c1-33-19-13-26-14-28-24(19)30-9-7-29(8-10-30)6-2-3-16-12-27-18-5-4-15(11-17(16)18)20-21(25)23(32)22(20)31/h4-5,11-14,27H,2-3,6-10,25H2,1H3