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

Systemtic Name: 2-[3-[1,3-benzodioxol-5-ylmethyl(methyl)amino]propyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-(2-diethylaminoethyl)ethanamide Openeye Name: 2-[3-[1,3-benzodioxol-5-ylmethyl(methyl)amino]propyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-(2-diethylaminoethyl)acetamide CAS Name: 2-[3-[1,3-benzodioxol-5-ylmethyl(methyl)amino]propyl-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]amino]-N-(2-diethylaminoethyl)acetamide IUPAC Name: 2-[3-[1,3-benzodioxol-5-ylmethyl(methyl)amino]propyl-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)amino]-N-(2-diethylaminoethyl)acetamide Traditional Name: N-(2-diethylaminoethyl)-2-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-[3-[methyl(piperonyl)amino]propyl]amino]acetamide Formula: C28H40N8O3 MolecularWeight: 536.669

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)CN(CCCN(C)CC1=CC2=C(C=C1)OCO2)C3=NC(=NC(=C3)C)N4C=CN=C4

Isomeric SMILES

CCN(CC)CCNC(=O)CN(CCCN(C)CC1=CC2=C(C=C1)OCO2)C3=NC(=NC(=C3)C)N4C=CN=C4

InChI

InChI=1S/C28H40N8O3/c1-5-34(6-2)14-11-30-27(37)19-35(26-16-22(3)31-28(32-26)36-15-10-29-20-36)13-7-12-33(4)18-23-8-9-24-25(17-23)39-21-38-24/h8-10,15-17,20H,5-7,11-14,18-19,21H2,1-4H3,(H,30,37)