(E)-6-[4-[(4-chlorophenyl)sulfonylamino]-1-thiophen-2-ylsulfonyl-pyrrolidin-2-yl]hex-5-enoic acid

Systemtic Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]-1-thiophen-2-ylsulfonyl-pyrrolidin-2-yl]hex-5-enoic acid Openeye Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]-1-(2-thienylsulfonyl)pyrrolidin-2-yl]hex-5-enoic acid CAS Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]-1-thiophen-2-ylsulfonyl-2-pyrrolidinyl]-5-hexenoic acid IUPAC Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]-1-thiophen-2-ylsulfonylpyrrolidin-2-yl]hex-5-enoic acid Traditional Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]-1-(2-thienylsulfonyl)pyrrolidin-2-yl]hex-5-enoic acid Formula: C20H23ClN2O6S3 MolecularWeight: 519.05442

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C=CCCCC(=O)O)S(=O)(=O)C2=CC=CS2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1C(CN(C1/C=C/CCCC(=O)O)S(=O)(=O)C2=CC=CS2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN2O6S3/c21-15-8-10-18(11-9-15)31(26,27)22-16-13-17(5-2-1-3-6-19(24)25)23(14-16)32(28,29)20-7-4-12-30-20/h2,4-5,7-12,16-17,22H,1,3,6,13-14H2,(H,24,25)/b5-2+