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

Systemtic Name: 2-methylsulfanyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-imidazole-4-carboxamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-2-(methylthio)-3-phenyl-4-imidazolecarboxamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-2-methylsulfanyl-3-phenylimidazole-4-carboxamide Traditional Name: N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-2-(methylthio)-3-phenyl-imidazole-4-carboxamide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O4S2/c1-30-21-22-14-18(25(21)15-7-3-2-4-8-15)20(27)23-17-13-16(9-10-19(17)26)31(28,29)24-11-5-6-12-24/h2-4,7-10,13-14,26H,5-6,11-12H2,1H3,(H,23,27)