N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[[1-(2-pyrimidinyl)-2-pyrrolyl]methyl]-3-piperidinamine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-3-amine Traditional Name: homoveratryl-methyl-[1-[[1-(2-pyrimidyl)pyrrol-2-yl]methyl]-3-piperidyl]amine Formula: C25H33N5O2 MolecularWeight: 435.56182

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCN(C2)CC3=CC=CN3C4=NC=CC=N4

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCN(C2)CC3=CC=CN3C4=NC=CC=N4

InChI

InChI=1S/C25H33N5O2/c1-28(16-11-20-9-10-23(31-2)24(17-20)32-3)21-7-4-14-29(18-21)19-22-8-5-15-30(22)25-26-12-6-13-27-25/h5-6,8-10,12-13,15,17,21H,4,7,11,14,16,18-19H2,1-3H3