3-ethyl-3-methyl-5-oxidanylidene-5-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino]pentanoic acid

Systemtic Name: 3-ethyl-3-methyl-5-oxidanylidene-5-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino]pentanoic acid Openeye Name: 3-ethyl-3-methyl-5-oxo-5-[4-(thiazol-2-ylsulfamoyl)anilino]pentanoic acid CAS Name: 3-ethyl-3-methyl-5-oxo-5-[4-(2-thiazolylsulfamoyl)anilino]pentanoic acid IUPAC Name: 3-ethyl-3-methyl-5-oxo-5-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]pentanoic acid Traditional Name: 3-ethyl-5-keto-3-methyl-5-[4-(thiazol-2-ylsulfamoyl)anilino]valeric acid Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CS2)CC(=O)O

Isomeric SMILES

CCC(C)(CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CS2)CC(=O)O

InChI

InChI=1S/C17H21N3O5S2/c1-3-17(2,11-15(22)23)10-14(21)19-12-4-6-13(7-5-12)27(24,25)20-16-18-8-9-26-16/h4-9H,3,10-11H2,1-2H3,(H,18,20)(H,19,21)(H,22,23)