3-(4-fluorophenyl)-2-methylsulfanyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-methylsulfanyl-imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-2-methylsulfanylimidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-2-(methylthio)imidazole-4-carboxamide Formula: C21H21FN4O4S2 MolecularWeight: 476.544243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)O

Isomeric SMILES

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)O

InChI

InChI=1S/C21H21FN4O4S2/c1-31-21-23-13-18(26(21)15-6-4-14(22)5-7-15)20(28)24-17-12-16(8-9-19(17)27)32(29,30)25-10-2-3-11-25/h4-9,12-13,27H,2-3,10-11H2,1H3,(H,24,28)