5-[2-[[1-(4-butoxyphenyl)sulfonylpyrrolidin-3-yl]amino]-1-oxidanyl-ethyl]-N-methyl-2-oxidanyl-benzenesulfonamide

Systemtic Name: 5-[2-[[1-(4-butoxyphenyl)sulfonylpyrrolidin-3-yl]amino]-1-oxidanyl-ethyl]-N-methyl-2-oxidanyl-benzenesulfonamide Openeye Name: 5-[2-[[1-(4-butoxyphenyl)sulfonylpyrrolidin-3-yl]amino]-1-hydroxy-ethyl]-2-hydroxy-N-methyl-benzenesulfonamide CAS Name: 5-[2-[[1-(4-butoxyphenyl)sulfonyl-3-pyrrolidinyl]amino]-1-hydroxyethyl]-2-hydroxy-N-methylbenzenesulfonamide IUPAC Name: 5-[2-[[1-(4-butoxyphenyl)sulfonylpyrrolidin-3-yl]amino]-1-hydroxyethyl]-2-hydroxy-N-methylbenzenesulfonamide Traditional Name: 5-[2-[[1-(4-butoxyphenyl)sulfonylpyrrolidin-3-yl]amino]-1-hydroxy-ethyl]-2-hydroxy-N-methyl-benzenesulfonamide Formula: C23H33N3O7S2 MolecularWeight: 527.65402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(C2)NCC(C3=CC(=C(C=C3)O)S(=O)(=O)NC)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(C2)NCC(C3=CC(=C(C=C3)O)S(=O)(=O)NC)O

InChI

InChI=1S/C23H33N3O7S2/c1-3-4-13-33-19-6-8-20(9-7-19)35(31,32)26-12-11-18(16-26)25-15-22(28)17-5-10-21(27)23(14-17)34(29,30)24-2/h5-10,14,18,22,24-25,27-28H,3-4,11-13,15-16H2,1-2H3