[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propyl] 2-sulfanylidene-2-(1-sulfanylidene-1,3,4-thiadiazol-2-yl)ethanoate

Systemtic Name: [3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propyl] 2-sulfanylidene-2-(1-sulfanylidene-1,3,4-thiadiazol-2-yl)ethanoate Openeye Name: [3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propyl] 2-thioxo-2-(1-thioxo-1,3,4-thiadiazol-2-yl)acetate CAS Name: 2-sulfanylidene-2-(1-sulfanylidene-1,3,4-thiadiazol-2-yl)acetic acid [3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropyl] ester IUPAC Name: [3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropyl] 2-sulfanylidene-2-(1-sulfanylidene-1,3,4-thiadiazol-2-yl)acetate Traditional Name: 2-thioxo-2-(1-thioxo-1,3,4-thiadiazol-2-yl)acetic acid [3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propyl] ester Formula: C18H20N2O6S3 MolecularWeight: 456.5562

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC(=O)C(=S)C2=NN=CS2=S)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC(=O)C(=S)C2=NN=CS2=S)O

InChI

InChI=1S/C18H20N2O6S3/c1-3-4-13-14(6-5-12(10(2)21)15(13)23)25-7-11(22)8-26-18(24)16(27)17-20-19-9-29(17)28/h5-6,9,11,22-23H,3-4,7-8H2,1-2H3