5-chloranyl-N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-N-(4-fluoro-3-morpholinosulfonyl-phenyl)-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[4-fluoro-3-(4-morpholinylsulfonyl)phenyl]-3-methyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)-3-methylpyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-N-(4-fluoro-3-morpholinosulfonyl-phenyl)-3-methyl-pyrazole-4-carboxamide Formula: C22H22ClFN4O4S MolecularWeight: 492.950883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H22ClFN4O4S/c1-15-20(21(23)28(26-15)14-16-5-3-2-4-6-16)22(29)25-17-7-8-18(24)19(13-17)33(30,31)27-9-11-32-12-10-27/h2-8,13H,9-12,14H2,1H3,(H,25,29)