3-[methyl(phenyl)amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[methyl(phenyl)amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(N-methylanilino)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(N-methylanilino)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(N-methylanilino)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(N-methylanilino)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C18H23N5O MolecularWeight: 325.40812

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)N1CCN(CC1)C2=NC=CC=N2)C3=CC=CC=C3

Isomeric SMILES

CN(CCC(=O)N1CCN(CC1)C2=NC=CC=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H23N5O/c1-21(16-6-3-2-4-7-16)11-8-17(24)22-12-14-23(15-13-22)18-19-9-5-10-20-18/h2-7,9-10H,8,11-15H2,1H3