5-chloranyl-3-methyl-N-(6-morpholin-4-ylpyridin-3-yl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-(6-morpholin-4-ylpyridin-3-yl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-N-(6-morpholino-3-pyridyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[6-(4-morpholinyl)-3-pyridinyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-N-(6-morpholin-4-ylpyridin-3-yl)-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-N-(6-morpholino-3-pyridyl)-1-phenyl-pyrazole-4-carboxamide Formula: C20H20ClN5O2 MolecularWeight: 397.8581

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CN=C(C=C2)N3CCOCC3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CN=C(C=C2)N3CCOCC3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H20ClN5O2/c1-14-18(19(21)26(24-14)16-5-3-2-4-6-16)20(27)23-15-7-8-17(22-13-15)25-9-11-28-12-10-25/h2-8,13H,9-12H2,1H3,(H,23,27)