2-(3-aminophenyl)-N-(3-chloranyl-4-morpholin-4-ylcarbonyl-phenyl)-5-methyl-pyrazole-3-carboxamide

Systemtic Name: 2-(3-aminophenyl)-N-(3-chloranyl-4-morpholin-4-ylcarbonyl-phenyl)-5-methyl-pyrazole-3-carboxamide Openeye Name: 2-(3-aminophenyl)-N-[3-chloro-4-(morpholine-4-carbonyl)phenyl]-5-methyl-pyrazole-3-carboxamide CAS Name: 2-(3-aminophenyl)-N-[3-chloro-4-[4-morpholinyl(oxo)methyl]phenyl]-5-methyl-3-pyrazolecarboxamide IUPAC Name: 2-(3-aminophenyl)-N-[3-chloro-4-(morpholine-4-carbonyl)phenyl]-5-methylpyrazole-3-carboxamide Traditional Name: 2-(3-aminophenyl)-N-[3-chloro-4-(morpholine-4-carbonyl)phenyl]-5-methyl-pyrazole-3-carboxamide Formula: C22H22ClN5O3 MolecularWeight: 439.89478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC(=C(C=C2)C(=O)N3CCOCC3)Cl)C4=CC(=CC=C4)N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC(=C(C=C2)C(=O)N3CCOCC3)Cl)C4=CC(=CC=C4)N

InChI

InChI=1S/C22H22ClN5O3/c1-14-11-20(28(26-14)17-4-2-3-15(24)12-17)21(29)25-16-5-6-18(19(23)13-16)22(30)27-7-9-31-10-8-27/h2-6,11-13H,7-10,24H2,1H3,(H,25,29)