2-[[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]oxy]ethanenitrile

Systemtic Name: 2-[[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]oxy]ethanenitrile Openeye Name: 2-[[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]oxy]acetonitrile CAS Name: 2-[[3-[3-[4-(5-methoxy-4-pyrimidinyl)-1-piperazinyl]propyl]-1H-indol-5-yl]oxy]acetonitrile IUPAC Name: 2-[[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-1H-indol-5-yl]oxy]acetonitrile Traditional Name: 2-[[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazino]propyl]-1H-indol-5-yl]oxy]acetonitrile Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=CN=C1N2CCN(CC2)CCCC3=CNC4=C3C=C(C=C4)OCC#N

Isomeric SMILES

COC1=CN=CN=C1N2CCN(CC2)CCCC3=CNC4=C3C=C(C=C4)OCC#N

InChI

InChI=1S/C22H26N6O2/c1-29-21-15-24-16-26-22(21)28-10-8-27(9-11-28)7-2-3-17-14-25-20-5-4-18(13-19(17)20)30-12-6-23/h4-5,13-16,25H,2-3,7-12H2,1H3