1-(4-fluorophenyl)-N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)pyrazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-(2-methyl-5-morpholinosulfonyl-phenyl)pyrazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-N-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)pyrazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-(2-methyl-5-morpholinosulfonyl-phenyl)pyrazole-3-carboxamide Formula: C21H21FN4O4S MolecularWeight: 444.479243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=NN(C=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=NN(C=C3)C4=CC=C(C=C4)F

InChI

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