4-[3-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propoxy]-1H-indole-2-carbonitrile

Systemtic Name: 4-[3-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propoxy]-1H-indole-2-carbonitrile Openeye Name: 4-[3-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propoxy]-1H-indole-2-carbonitrile CAS Name: 4-[3-[4-[2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]propoxy]-1H-indole-2-carbonitrile IUPAC Name: 4-[3-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propoxy]-1H-indole-2-carbonitrile Traditional Name: 4-[3-[4-(2,6-dipyrrolidinopyrimidin-4-yl)piperazino]propoxy]-1H-indole-2-carbonitrile Formula: C28H36N8O MolecularWeight: 500.63844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC(=N2)N3CCCC3)N4CCN(CC4)CCCOC5=CC=CC6=C5C=C(N6)C#N

Isomeric SMILES

C1CCN(C1)C2=CC(=NC(=N2)N3CCCC3)N4CCN(CC4)CCCOC5=CC=CC6=C5C=C(N6)C#N

InChI

InChI=1S/C28H36N8O/c29-21-22-19-23-24(30-22)7-5-8-25(23)37-18-6-9-33-14-16-35(17-15-33)27-20-26(34-10-1-2-11-34)31-28(32-27)36-12-3-4-13-36/h5,7-8,19-20,30H,1-4,6,9-18H2