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

Systemtic Name: 2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-[2-(1,3-benzodioxol-5-yl)ethyl]ethanamide Openeye Name: 2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-[2-(1,3-benzodioxol-5-yl)ethyl]acetamide CAS Name: 2-[3-acetamidopropyl-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]amino]-N-[2-(1,3-benzodioxol-5-yl)ethyl]acetamide IUPAC Name: 2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)amino]-N-[2-(1,3-benzodioxol-5-yl)ethyl]acetamide Traditional Name: 2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-homopiperonyl-acetamide Formula: C24H29N7O4 MolecularWeight: 479.53156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N(CCCNC(=O)C)CC(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N(CCCNC(=O)C)CC(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H29N7O4/c1-17-12-22(29-24(28-17)31-11-9-25-15-31)30(10-3-7-26-18(2)32)14-23(33)27-8-6-19-4-5-20-21(13-19)35-16-34-20/h4-5,9,11-13,15H,3,6-8,10,14,16H2,1-2H3,(H,26,32)(H,27,33)