2-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCCO2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCCO2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H25N5O3/c1-23(14-16-3-4-17-18(13-16)28-12-11-27-17)15-19(26)24-7-9-25(10-8-24)20-21-5-2-6-22-20/h2-6,13H,7-12,14-15H2,1H3