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

Systemtic Name: [4-[5-[(3-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-cyclobutyl-methanone Openeye Name: [4-[5-[(3-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-cyclobutyl-methanone CAS Name: [4-[5-[(3-chlorophenyl)methyl]-2,6-dimethyl-4-pyrimidinyl]-1-piperazinyl]-cyclobutylmethanone IUPAC Name: [4-[5-[(3-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl]piperazin-1-yl]-cyclobutylmethanone Traditional Name: [4-[5-(3-chlorobenzyl)-2,6-dimethyl-pyrimidin-4-yl]piperazino]-cyclobutyl-methanone Formula: C22H27ClN4O MolecularWeight: 398.92898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3CCC3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3CCC3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H27ClN4O/c1-15-20(14-17-5-3-8-19(23)13-17)21(25-16(2)24-15)26-9-11-27(12-10-26)22(28)18-6-4-7-18/h3,5,8,13,18H,4,6-7,9-12,14H2,1-2H3