2-[ethyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-amino]-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[ethyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-amino]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[ethyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-amino]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[ethyl-[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonylamino]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[ethyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylamino]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[ethyl-(4-pyrrolidinosulfonylphenyl)sulfonyl-amino]-N-(4-fluorobenzyl)acetamide Formula: C21H26FN3O5S2 MolecularWeight: 483.576643

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)F)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)F)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H26FN3O5S2/c1-2-24(16-21(26)23-15-17-5-7-18(22)8-6-17)31(27,28)19-9-11-20(12-10-19)32(29,30)25-13-3-4-14-25/h5-12H,2-4,13-16H2,1H3,(H,23,26)