N-[2-[[5-chloranyl-2-[(4-piperidin-1-ylcarbonylphenyl)amino]pyrimidin-4-yl]amino]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[2-[[5-chloranyl-2-[(4-piperidin-1-ylcarbonylphenyl)amino]pyrimidin-4-yl]amino]phenyl]cyclopropanecarboxamide Openeye Name: N-[2-[[5-chloro-2-[4-(piperidine-1-carbonyl)anilino]pyrimidin-4-yl]amino]phenyl]cyclopropanecarboxamide CAS Name: N-[2-[[5-chloro-2-[4-[oxo(1-piperidinyl)methyl]anilino]-4-pyrimidinyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[2-[[5-chloro-2-[4-(piperidine-1-carbonyl)anilino]pyrimidin-4-yl]amino]phenyl]cyclopropanecarboxamide Traditional Name: N-[2-[[5-chloro-2-[4-(piperidine-1-carbonyl)anilino]pyrimidin-4-yl]amino]phenyl]cyclopropanecarboxamide Formula: C26H27ClN6O2 MolecularWeight: 490.98458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4NC(=O)C5CC5)Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4NC(=O)C5CC5)Cl

InChI

InChI=1S/C26H27ClN6O2/c27-20-16-28-26(29-19-12-10-18(11-13-19)25(35)33-14-4-1-5-15-33)32-23(20)30-21-6-2-3-7-22(21)31-24(34)17-8-9-17/h2-3,6-7,10-13,16-17H,1,4-5,8-9,14-15H2,(H,31,34)(H2,28,29,30,32)