2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-N-[1-(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-[1-(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-[1-(2,3-dihydrobenzofuran-5-yl)ethyl]acetamide CAS Name: 2-[3-acetamidopropyl-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]amino]-N-[1-(2,3-dihydrobenzofuran-5-yl)ethyl]acetamide IUPAC Name: 2-[3-acetamidopropyl-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)amino]-N-[1-(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-(1-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)NC(C)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

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

InChI

InChI=1S/C25H31N7O3/c1-17-13-23(30-25(28-17)32-11-9-26-16-32)31(10-4-8-27-19(3)33)15-24(34)29-18(2)20-5-6-22-21(14-20)7-12-35-22/h5-6,9,11,13-14,16,18H,4,7-8,10,12,15H2,1-3H3,(H,27,33)(H,29,34)