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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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