[2-[[(5-bromanylpyrimidin-2-yl)amino]methyl]-3,3-dimethyl-piperidin-1-yl]-(3-phenylphenyl)methanone

Systemtic Name: [2-[[(5-bromanylpyrimidin-2-yl)amino]methyl]-3,3-dimethyl-piperidin-1-yl]-(3-phenylphenyl)methanone Openeye Name: [2-[[(5-bromopyrimidin-2-yl)amino]methyl]-3,3-dimethyl-1-piperidyl]-(3-phenylphenyl)methanone CAS Name: [2-[[(5-bromo-2-pyrimidinyl)amino]methyl]-3,3-dimethyl-1-piperidinyl]-(3-phenylphenyl)methanone IUPAC Name: [2-[[(5-bromopyrimidin-2-yl)amino]methyl]-3,3-dimethylpiperidin-1-yl]-(3-phenylphenyl)methanone Traditional Name: [2-[[(5-bromopyrimidin-2-yl)amino]methyl]-3,3-dimethyl-piperidino]-(3-phenylphenyl)methanone Formula: C25H27BrN4O MolecularWeight: 479.41208

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN(C1CNC2=NC=C(C=N2)Br)C(=O)C3=CC=CC(=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CCCN(C1CNC2=NC=C(C=N2)Br)C(=O)C3=CC=CC(=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H27BrN4O/c1-25(2)12-7-13-30(22(25)17-29-24-27-15-21(26)16-28-24)23(31)20-11-6-10-19(14-20)18-8-4-3-5-9-18/h3-6,8-11,14-16,22H,7,12-13,17H2,1-2H3,(H,27,28,29)