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

Systemtic Name: 5-bromanyl-N-[4-[(2-methyl-6-piperidin-1-yl-pyrimidin-4-yl)amino]phenyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[4-[[2-methyl-6-(1-piperidyl)pyrimidin-4-yl]amino]phenyl]furan-2-carboxamide CAS Name: 5-bromo-N-[4-[[2-methyl-6-(1-piperidinyl)-4-pyrimidinyl]amino]phenyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[4-[(2-methyl-6-piperidin-1-ylpyrimidin-4-yl)amino]phenyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[4-[(2-methyl-6-piperidino-pyrimidin-4-yl)amino]phenyl]-2-furamide Formula: C21H22BrN5O2 MolecularWeight: 456.33568

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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)N4CCCCC4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)Br)N4CCCCC4

InChI

InChI=1S/C21H22BrN5O2/c1-14-23-19(13-20(24-14)27-11-3-2-4-12-27)25-15-5-7-16(8-6-15)26-21(28)17-9-10-18(22)29-17/h5-10,13H,2-4,11-12H2,1H3,(H,26,28)(H,23,24,25)