2-[(5-fluoranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]ethanamide

Systemtic Name: 2-[(5-fluoranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]ethanamide Openeye Name: 2-[(5-fluoro-2-methoxy-phenyl)sulfonyl-methyl-amino]-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]acetamide CAS Name: 2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]-N-[[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]acetamide IUPAC Name: 2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]acetamide Traditional Name: 2-[(5-fluoro-2-methoxy-phenyl)sulfonyl-methyl-amino]-N-(4-pyrrolidinosulfonylbenzyl)acetamide Formula: C21H26FN3O6S2 MolecularWeight: 499.576043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)S(=O)(=O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CN(CC(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)S(=O)(=O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C21H26FN3O6S2/c1-24(33(29,30)20-13-17(22)7-10-19(20)31-2)15-21(26)23-14-16-5-8-18(9-6-16)32(27,28)25-11-3-4-12-25/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,23,26)