2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N,N-diethyl-ethanamide

Systemtic Name: 2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N,N-diethyl-ethanamide Openeye Name: 2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N,N-diethyl-acetamide CAS Name: 2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]amino]-N,N-diethylacetamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-ylmethylamino)propyl-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)amino]-N,N-diethylacetamide Traditional Name: N,N-diethyl-2-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-[3-(piperonylamino)propyl]amino]acetamide Formula: C25H33N7O3 MolecularWeight: 479.57462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN(CCCNCC1=CC2=C(C=C1)OCO2)C3=NC(=NC(=C3)C)N4C=CN=C4

Isomeric SMILES

CCN(CC)C(=O)CN(CCCNCC1=CC2=C(C=C1)OCO2)C3=NC(=NC(=C3)C)N4C=CN=C4

InChI

InChI=1S/C25H33N7O3/c1-4-30(5-2)24(33)16-31(23-13-19(3)28-25(29-23)32-12-10-27-17-32)11-6-9-26-15-20-7-8-21-22(14-20)35-18-34-21/h7-8,10,12-14,17,26H,4-6,9,11,15-16,18H2,1-3H3