3-[(5Z)-4-oxidanylidene-2-sulfanylidene-5-[[4-[2,2,2-tris(chloranyl)-1-(2-methylpropanoylamino)ethoxy]phenyl]methylidene]-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 3-[(5Z)-4-oxidanylidene-2-sulfanylidene-5-[[4-[2,2,2-tris(chloranyl)-1-(2-methylpropanoylamino)ethoxy]phenyl]methylidene]-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[(5Z)-4-oxo-2-thioxo-5-[[4-[2,2,2-trichloro-1-(2-methylpropanoylamino)ethoxy]phenyl]methylene]thiazolidin-3-yl]propanoic acid CAS Name: 3-[(5Z)-4-oxo-2-sulfanylidene-5-[[4-[2,2,2-trichloro-1-[(2-methyl-1-oxopropyl)amino]ethoxy]phenyl]methylidene]-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[(5Z)-4-oxo-2-sulfanylidene-5-[[4-[2,2,2-trichloro-1-(2-methylpropanoylamino)ethoxy]phenyl]methylidene]-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[(5Z)-4-keto-2-thioxo-5-[4-[2,2,2-trichloro-1-(isobutyrylamino)ethoxy]benzylidene]thiazolidin-3-yl]propionic acid Formula: C19H19Cl3N2O5S2 MolecularWeight: 525.85356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(C(Cl)(Cl)Cl)OC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)O

Isomeric SMILES

CC(C)C(=O)NC(C(Cl)(Cl)Cl)OC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCC(=O)O

InChI

InChI=1S/C19H19Cl3N2O5S2/c1-10(2)15(27)23-17(19(20,21)22)29-12-5-3-11(4-6-12)9-13-16(28)24(18(30)31-13)8-7-14(25)26/h3-6,9-10,17H,7-8H2,1-2H3,(H,23,27)(H,25,26)/b13-9-