5-(4-fluorophenyl)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-1H-pyrazole-4-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=C(NN=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=C(NN=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4O4S/c22-17-7-5-15(6-8-17)20-18(14-24-25-20)21(27)23-13-16-3-1-2-4-19(16)31(28,29)26-9-11-30-12-10-26/h1-8,14H,9-13H2,(H,23,27)(H,24,25)