5-chloranyl-3-methyl-N-(4-morpholin-4-ylphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-(4-morpholin-4-ylphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-N-(4-morpholinophenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[4-(4-morpholinyl)phenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-N-(4-morpholin-4-ylphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-N-(4-morpholinophenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN4O2/c1-15-19(20(22)26(24-15)18-5-3-2-4-6-18)21(27)23-16-7-9-17(10-8-16)25-11-13-28-14-12-25/h2-10H,11-14H2,1H3,(H,23,27)