5-(2-bromanyl-5-tert-butyl-phenoxy)-N-[2-(3-imidazol-1-ylpropylamino)-4,6-dimethoxy-pyrimidin-5-yl]furan-2-carboxamide

Systemtic Name: 5-(2-bromanyl-5-tert-butyl-phenoxy)-N-[2-(3-imidazol-1-ylpropylamino)-4,6-dimethoxy-pyrimidin-5-yl]furan-2-carboxamide Openeye Name: 5-(2-bromo-5-tert-butyl-phenoxy)-N-[2-(3-imidazol-1-ylpropylamino)-4,6-dimethoxy-pyrimidin-5-yl]furan-2-carboxamide CAS Name: 5-(2-bromo-5-tert-butylphenoxy)-N-[2-[3-(1-imidazolyl)propylamino]-4,6-dimethoxy-5-pyrimidinyl]-2-furancarboxamide IUPAC Name: 5-(2-bromo-5-tert-butylphenoxy)-N-[2-(3-imidazol-1-ylpropylamino)-4,6-dimethoxypyrimidin-5-yl]furan-2-carboxamide Traditional Name: 5-(2-bromo-5-tert-butyl-phenoxy)-N-[2-(3-imidazol-1-ylpropylamino)-4,6-dimethoxy-pyrimidin-5-yl]-2-furamide Formula: C27H31BrN6O5 MolecularWeight: 599.47624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)Br)OC2=CC=C(O2)C(=O)NC3=C(N=C(N=C3OC)NCCCN4C=CN=C4)OC

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)Br)OC2=CC=C(O2)C(=O)NC3=C(N=C(N=C3OC)NCCCN4C=CN=C4)OC

InChI

InChI=1S/C27H31BrN6O5/c1-27(2,3)17-7-8-18(28)20(15-17)39-21-10-9-19(38-21)23(35)31-22-24(36-4)32-26(33-25(22)37-5)30-11-6-13-34-14-12-29-16-34/h7-10,12,14-16H,6,11,13H2,1-5H3,(H,31,35)(H,30,32,33)