5-[(E)-pent-1-enyl]-3-(phenylsulfonylamino)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 5-[(E)-pent-1-enyl]-3-(phenylsulfonylamino)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(benzenesulfonamido)-5-[(E)-pent-1-enyl]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(benzenesulfonamido)-5-[(E)-pent-1-enyl]-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(benzenesulfonamido)-5-[(E)-pent-1-enyl]-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxylic acid Traditional Name: 3-(benzenesulfonamido)-5-[(E)-pent-1-enyl]-1-(2-thienylsulfonyl)proline Formula: C20H24N2O6S3 MolecularWeight: 484.60936

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1CC(C(N1S(=O)(=O)C2=CC=CS2)C(=O)O)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC/C=C/C1CC(C(N1S(=O)(=O)C2=CC=CS2)C(=O)O)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O6S3/c1-2-3-5-9-15-14-17(21-30(25,26)16-10-6-4-7-11-16)19(20(23)24)22(15)31(27,28)18-12-8-13-29-18/h4-13,15,17,19,21H,2-3,14H2,1H3,(H,23,24)/b9-5+