2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)ethanamide; 2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanoic acid

Systemtic Name: 2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)ethanamide; 2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanoic acid Openeye Name: 2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)acetamide; 2-(1,3,4-thiadiazol-2-ylsulfanyl)acetic acid CAS Name: 2-(4-acetyl-3-hydroxy-2-propylphenoxy)acetamide; 2-(1,3,4-thiadiazol-2-ylthio)acetic acid IUPAC Name: 2-(4-acetyl-3-hydroxy-2-propylphenoxy)acetamide; 2-(1,3,4-thiadiazol-2-ylsulfanyl)acetic acid Traditional Name: 2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)acetamide; 2-(1,3,4-thiadiazol-2-ylthio)acetic acid Formula: C17H21N3O6S2 MolecularWeight: 427.49514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(=O)N.C1=NN=C(S1)SCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(=O)N.C1=NN=C(S1)SCC(=O)O

InChI

InChI=1S/C13H17NO4.C4H4N2O2S2/c1-3-4-10-11(18-7-12(14)16)6-5-9(8(2)15)13(10)17;7-3(8)1-9-4-6-5-2-10-4/h5-6,17H,3-4,7H2,1-2H3,(H2,14,16);2H,1H2,(H,7,8)