4-[[6-chloranyl-4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]pyridin-2-yl]methyl]-N-methyl-piperazine-1-carboxamide

Systemtic Name: 4-[[6-chloranyl-4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]pyridin-2-yl]methyl]-N-methyl-piperazine-1-carboxamide Openeye Name: 4-[[6-chloro-4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]-2-pyridyl]methyl]-N-methyl-piperazine-1-carboxamide CAS Name: 4-[[6-chloro-4-[[4-(2-phenyl-3-pyrazolyl)-2-pyrimidinyl]amino]-2-pyridinyl]methyl]-N-methyl-1-piperazinecarboxamide IUPAC Name: 4-[[6-chloro-4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]pyridin-2-yl]methyl]-N-methylpiperazine-1-carboxamide Traditional Name: 4-[[6-chloro-4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]-2-pyridyl]methyl]-N-methyl-piperazine-1-carboxamide Formula: C25H26ClN9O MolecularWeight: 503.98664

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)N1CCN(CC1)CC2=NC(=CC(=C2)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5)Cl

Isomeric SMILES

CNC(=O)N1CCN(CC1)CC2=NC(=CC(=C2)NC3=NC=CC(=N3)C4=CC=NN4C5=CC=CC=C5)Cl

InChI

InChI=1S/C25H26ClN9O/c1-27-25(36)34-13-11-33(12-14-34)17-19-15-18(16-23(26)30-19)31-24-28-9-7-21(32-24)22-8-10-29-35(22)20-5-3-2-4-6-20/h2-10,15-16H,11-14,17H2,1H3,(H,27,36)(H,28,30,31,32)