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

Systemtic Name: 2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]ethanamide Openeye Name: 2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-[2-(2,3-dihydrobenzofuran-5-yl)ethyl]acetamide CAS Name: 2-[3-acetamidopropyl-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]amino]-N-[2-(2,3-dihydrobenzofuran-5-yl)ethyl]acetamide IUPAC Name: 2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)amino]-N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]acetamide Traditional Name: 2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-(2-coumaran-5-ylethyl)acetamide Formula: C25H31N7O3 MolecularWeight: 477.55874

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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)OCC4

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N(CCCNC(=O)C)CC(=O)NCCC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C25H31N7O3/c1-18-14-23(30-25(29-18)32-12-10-26-17-32)31(11-3-8-27-19(2)33)16-24(34)28-9-6-20-4-5-22-21(15-20)7-13-35-22/h4-5,10,12,14-15,17H,3,6-9,11,13,16H2,1-2H3,(H,27,33)(H,28,34)