1-(4-fluorophenyl)-5-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-5-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-1,2,4-triazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-5-methyl-N-[(2-morpholinosulfonylphenyl)methyl]-1,2,4-triazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-5-methyl-N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-1,2,4-triazole-3-carboxamide IUPAC Name: 1-(4-fluorophenyl)-5-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-1,2,4-triazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-5-methyl-N-(2-morpholinosulfonylbenzyl)-1,2,4-triazole-3-carboxamide Formula: C21H22FN5O4S MolecularWeight: 459.493883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H22FN5O4S/c1-15-24-20(25-27(15)18-8-6-17(22)7-9-18)21(28)23-14-16-4-2-3-5-19(16)32(29,30)26-10-12-31-13-11-26/h2-9H,10-14H2,1H3,(H,23,28)