1-[5-chloranyl-2-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]phenyl]propan-1-one

Systemtic Name: 1-[5-chloranyl-2-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]phenyl]propan-1-one Openeye Name: 1-[5-chloro-2-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]phenyl]propan-1-one CAS Name: 1-[5-chloro-2-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethoxy]phenyl]-1-propanone IUPAC Name: 1-[5-chloro-2-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]phenyl]propan-1-one Traditional Name: 1-[5-chloro-2-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethoxy]phenyl]propan-1-one Formula: C19H21ClN4O3 MolecularWeight: 388.84804

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC(=C1)Cl)OCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCC(=O)C1=C(C=CC(=C1)Cl)OCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C19H21ClN4O3/c1-2-16(25)15-12-14(20)4-5-17(15)27-13-18(26)23-8-10-24(11-9-23)19-21-6-3-7-22-19/h3-7,12H,2,8-11,13H2,1H3