2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-4-oxidanyl-5-(1,3-thiazol-2-ylsulfanyl)pentanoic acid

Systemtic Name: 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-4-oxidanyl-5-(1,3-thiazol-2-ylsulfanyl)pentanoic acid Openeye Name: 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-4-hydroxy-5-thiazol-2-ylsulfanyl-pentanoic acid CAS Name: 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-4-hydroxy-5-(2-thiazolylthio)pentanoic acid IUPAC Name: 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-4-hydroxy-5-(1,3-thiazol-2-ylsulfanyl)pentanoic acid Traditional Name: 4-hydroxy-2-[(4-m-phenetylphenyl)sulfonylamino]-5-(thiazol-2-ylthio)valeric acid Formula: C22H24N2O6S3 MolecularWeight: 508.63076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC(CSC3=NC=CS3)O)C(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC(CSC3=NC=CS3)O)C(=O)O

InChI

InChI=1S/C22H24N2O6S3/c1-2-30-18-5-3-4-16(12-18)15-6-8-19(9-7-15)33(28,29)24-20(21(26)27)13-17(25)14-32-22-23-10-11-31-22/h3-12,17,20,24-25H,2,13-14H2,1H3,(H,26,27)