N-[1-[4-(2-methylsulfonylphenyl)phenyl]carbonylpyrrolidin-3-yl]-1,2-benzoxazole-5-sulfonamide

Systemtic Name: N-[1-[4-(2-methylsulfonylphenyl)phenyl]carbonylpyrrolidin-3-yl]-1,2-benzoxazole-5-sulfonamide Openeye Name: N-[1-[4-(2-methylsulfonylphenyl)benzoyl]pyrrolidin-3-yl]-1,2-benzoxazole-5-sulfonamide CAS Name: N-[1-[[4-(2-methylsulfonylphenyl)phenyl]-oxomethyl]-3-pyrrolidinyl]-1,2-benzoxazole-5-sulfonamide IUPAC Name: N-[1-[4-(2-methylsulfonylphenyl)benzoyl]pyrrolidin-3-yl]-1,2-benzoxazole-5-sulfonamide Traditional Name: N-[1-[4-(2-mesylphenyl)benzoyl]pyrrolidin-3-yl]indoxazene-5-sulfonamide Formula: C25H23N3O6S2 MolecularWeight: 525.59662

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)C(=O)N3CCC(C3)NS(=O)(=O)C4=CC5=C(C=C4)ON=C5

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)C(=O)N3CCC(C3)NS(=O)(=O)C4=CC5=C(C=C4)ON=C5

InChI

InChI=1S/C25H23N3O6S2/c1-35(30,31)24-5-3-2-4-22(24)17-6-8-18(9-7-17)25(29)28-13-12-20(16-28)27-36(32,33)21-10-11-23-19(14-21)15-26-34-23/h2-11,14-15,20,27H,12-13,16H2,1H3