3-[4-[[5-bromanyl-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]-N-propan-2-yl-propanamide

Systemtic Name: 3-[4-[[5-bromanyl-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]-N-propan-2-yl-propanamide Openeye Name: 3-[4-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]-N-isopropyl-propanamide CAS Name: 3-[4-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]amino]phenyl]-N-propan-2-ylpropanamide IUPAC Name: 3-[4-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]-N-propan-2-ylpropanamide Traditional Name: 3-[4-[[5-bromo-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]-N-isopropyl-propionamide Formula: C22H26BrN7O MolecularWeight: 484.39214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CCC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=NNC(=C3)C4CC4)Br

Isomeric SMILES

CC(C)NC(=O)CCC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=NNC(=C3)C4CC4)Br

InChI

InChI=1S/C22H26BrN7O/c1-13(2)25-20(31)10-5-14-3-8-16(9-4-14)26-22-24-12-17(23)21(28-22)27-19-11-18(29-30-19)15-6-7-15/h3-4,8-9,11-13,15H,5-7,10H2,1-2H3,(H,25,31)(H3,24,26,27,28,29,30)