N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-ethylpyrimidin-5-yl)methyl]-1-pyridin-4-yl-methanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-ethylpyrimidin-5-yl)methyl]-1-pyridin-4-yl-methanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-ethylpyrimidin-5-yl)methyl]-1-(4-pyridyl)methanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-ethyl-5-pyrimidinyl)methyl]-1-pyridin-4-ylmethanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-ethylpyrimidin-5-yl)methyl]-1-pyridin-4-ylmethanamine Traditional Name: (2-ethylpyrimidin-5-yl)methyl-piperonyl-(4-pyridylmethyl)amine Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C=N1)CN(CC2=CC=NC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=NC=C(C=N1)CN(CC2=CC=NC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N4O2/c1-2-21-23-10-18(11-24-21)14-25(12-16-5-7-22-8-6-16)13-17-3-4-19-20(9-17)27-15-26-19/h3-11H,2,12-15H2,1H3