4-(4-chloranyl-2-methyl-phenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one CAS Name: 4-(4-chloro-2-methylphenoxy)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(4-chloro-2-methylphenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-1-[4-(2-pyrimidyl)piperazino]butan-1-one Formula: C19H23ClN4O2 MolecularWeight: 374.86452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C19H23ClN4O2/c1-15-14-16(20)5-6-17(15)26-13-2-4-18(25)23-9-11-24(12-10-23)19-21-7-3-8-22-19/h3,5-8,14H,2,4,9-13H2,1H3