2-azanyl-3,3-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]butan-1-one

Systemtic Name: 2-azanyl-3,3-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]butan-1-one Openeye Name: 2-amino-3,3-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]butan-1-one CAS Name: 2-amino-3,3-dimethyl-1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]phenyl]-1-butanone IUPAC Name: 2-amino-3,3-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]butan-1-one Traditional Name: 2-amino-3,3-dimethyl-1-[4-[4-(2-pyrimidyl)piperazino]phenyl]butan-1-one Formula: C20H27N5O MolecularWeight: 353.46128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N5O/c1-20(2,3)18(21)17(26)15-5-7-16(8-6-15)24-11-13-25(14-12-24)19-22-9-4-10-23-19/h4-10,18H,11-14,21H2,1-3H3