N-methyl-1-[1-[2-(2-methylphenyl)ethyl]piperidin-3-yl]-N-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]methanamine

Systemtic Name: N-methyl-1-[1-[2-(2-methylphenyl)ethyl]piperidin-3-yl]-N-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]methanamine Openeye Name: N-methyl-1-[1-[2-(o-tolyl)ethyl]-3-piperidyl]-N-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]methanamine CAS Name: N-methyl-1-[1-[2-(2-methylphenyl)ethyl]-3-piperidinyl]-N-[[1-(2-pyrimidinyl)-2-pyrrolyl]methyl]methanamine IUPAC Name: N-methyl-1-[1-[2-(2-methylphenyl)ethyl]piperidin-3-yl]-N-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]methanamine Traditional Name: methyl-[[1-[2-(o-tolyl)ethyl]-3-piperidyl]methyl]-[[1-(2-pyrimidyl)pyrrol-2-yl]methyl]amine Formula: C25H33N5 MolecularWeight: 403.56302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCN2CCCC(C2)CN(C)CC3=CC=CN3C4=NC=CC=N4

Isomeric SMILES

CC1=CC=CC=C1CCN2CCCC(C2)CN(C)CC3=CC=CN3C4=NC=CC=N4

InChI

InChI=1S/C25H33N5/c1-21-8-3-4-10-23(21)12-17-29-15-5-9-22(19-29)18-28(2)20-24-11-6-16-30(24)25-26-13-7-14-27-25/h3-4,6-8,10-11,13-14,16,22H,5,9,12,15,17-20H2,1-2H3