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

Systemtic Name: 3-[[2-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazin-1-yl]-1-propyl-indol-5-yl]amino]-4-methyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[[2-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazin-1-yl]-1-propyl-indol-5-yl]amino]-4-methyl-cyclobut-3-ene-1,2-dione CAS Name: 3-[[2-[4-(5-methoxy-4-pyrimidinyl)-3-methyl-1-piperazinyl]-1-propyl-5-indolyl]amino]-4-methylcyclobut-3-ene-1,2-dione IUPAC Name: 3-[[2-[4-(5-methoxypyrimidin-4-yl)-3-methylpiperazin-1-yl]-1-propylindol-5-yl]amino]-4-methylcyclobut-3-ene-1,2-dione Traditional Name: 3-[[2-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazino]-1-propyl-indol-5-yl]amino]-4-methyl-cyclobut-3-ene-1,2-quinone Formula: C26H30N6O3 MolecularWeight: 474.5548

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC3=C(C(=O)C3=O)C)C=C1N4CCN(C(C4)C)C5=NC=NC=C5OC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC3=C(C(=O)C3=O)C)C=C1N4CCN(C(C4)C)C5=NC=NC=C5OC

InChI

InChI=1S/C26H30N6O3/c1-5-8-32-20-7-6-19(29-23-17(3)24(33)25(23)34)11-18(20)12-22(32)30-9-10-31(16(2)14-30)26-21(35-4)13-27-15-28-26/h6-7,11-13,15-16,29H,5,8-10,14H2,1-4H3