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

Systemtic Name: 3-chloranyl-2,2-dimethyl-1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]propan-1-one Openeye Name: 3-chloro-2,2-dimethyl-1-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 3-chloro-2,2-dimethyl-1-[4-[6-methyl-2-(3-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-chloro-2,2-dimethyl-1-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]propan-1-one Traditional Name: 3-chloro-2,2-dimethyl-1-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]propan-1-one Formula: C21H27ClN4O MolecularWeight: 386.91828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CC(=N2)N3CCN(CC3)C(=O)C(C)(C)CCl)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=CC(=N2)N3CCN(CC3)C(=O)C(C)(C)CCl)C

InChI

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