(3-bromophenyl)-[4-[2,6-dimethyl-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-[2,6-dimethyl-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: [4-(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)piperazin-1-yl]-(3-bromophenyl)methanone CAS Name: (3-bromophenyl)-[4-[2,6-dimethyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: [4-(5-benzyl-2,6-dimethylpyrimidin-4-yl)piperazin-1-yl]-(3-bromophenyl)methanone Traditional Name: [4-(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)piperazino]-(3-bromophenyl)methanone Formula: C24H25BrN4O MolecularWeight: 465.3855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3=CC(=CC=C3)Br)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3=CC(=CC=C3)Br)CC4=CC=CC=C4

InChI

InChI=1S/C24H25BrN4O/c1-17-22(15-19-7-4-3-5-8-19)23(27-18(2)26-17)28-11-13-29(14-12-28)24(30)20-9-6-10-21(25)16-20/h3-10,16H,11-15H2,1-2H3