1-[4-[5-[(3-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[5-[(3-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[5-[(3-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[5-[(3-chlorophenyl)methyl]-2,6-dimethyl-4-pyrimidinyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[5-[(3-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[5-(3-chlorobenzyl)-2,6-dimethyl-pyrimidin-4-yl]piperazino]-2-methyl-propan-1-one Formula: C21H27ClN4O MolecularWeight: 386.91828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C(C)C)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C(C)C)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H27ClN4O/c1-14(2)21(27)26-10-8-25(9-11-26)20-19(15(3)23-16(4)24-20)13-17-6-5-7-18(22)12-17/h5-7,12,14H,8-11,13H2,1-4H3