3-(4-fluorophenyl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)-1H-pyrazole-5-carboxamide CAS Name: 3-(4-fluorophenyl)-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-fluorophenyl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)-1H-pyrazole-5-carboxamide Formula: C21H21FN4O4S MolecularWeight: 444.479243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H21FN4O4S/c1-14-2-7-17(12-20(14)31(28,29)26-8-10-30-11-9-26)23-21(27)19-13-18(24-25-19)15-3-5-16(22)6-4-15/h2-7,12-13H,8-11H2,1H3,(H,23,27)(H,24,25)