4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)benzamide

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)benzamide Openeye Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(4-fluoro-3-morpholinosulfonyl-phenyl)benzamide CAS Name: 4-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-[4-fluoro-3-(4-morpholinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)benzamide Traditional Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(4-fluoro-3-morpholinosulfonyl-phenyl)benzamide Formula: C22H22ClFN4O4S MolecularWeight: 492.950883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4)C)Cl

InChI

InChI=1S/C22H22ClFN4O4S/c1-14-21(23)15(2)28(26-14)18-6-3-16(4-7-18)22(29)25-17-5-8-19(24)20(13-17)33(30,31)27-9-11-32-12-10-27/h3-8,13H,9-12H2,1-2H3,(H,25,29)