5-bromanyl-N-[4-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]phenyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[4-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]phenyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[4-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]phenyl]furan-2-carboxamide CAS Name: 5-bromo-N-[4-[[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino]phenyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[4-[(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)amino]phenyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[4-[(2-methyl-6-pyrrolidino-pyrimidin-4-yl)amino]phenyl]-2-furamide Formula: C20H20BrN5O2 MolecularWeight: 442.3091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)Br)N4CCCC4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)Br)N4CCCC4

InChI

InChI=1S/C20H20BrN5O2/c1-13-22-18(12-19(23-13)26-10-2-3-11-26)24-14-4-6-15(7-5-14)25-20(27)16-8-9-17(21)28-16/h4-9,12H,2-3,10-11H2,1H3,(H,25,27)(H,22,23,24)