3-[1-(2,4-dichlorophenyl)ethylamino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[1-(2,4-dichlorophenyl)ethylamino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-(2,4-dichlorophenyl)ethylamino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-[1-(2,4-dichlorophenyl)ethylamino]-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[1-(2,4-dichlorophenyl)ethylamino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-(2,4-dichlorophenyl)ethylamino]-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C19H23Cl2N5O MolecularWeight: 408.32482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23Cl2N5O/c1-14(16-4-3-15(20)13-17(16)21)22-8-5-18(27)25-9-11-26(12-10-25)19-23-6-2-7-24-19/h2-4,6-7,13-14,22H,5,8-12H2,1H3