2-[(5Z)-4-oxidanylidene-5-[2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 2-[(5Z)-4-oxidanylidene-5-[2-oxidanylidene-1-(phenylmethyl)indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 2-[(5Z)-5-(1-benzyl-2-oxo-indolin-3-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 2-[(5Z)-4-oxo-5-[2-oxo-1-(phenylmethyl)-3-indolylidene]-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 2-[(5Z)-5-(1-benzyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 2-[(5Z)-5-(1-benzyl-2-keto-indolin-3-ylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C21H16N2O4S2 MolecularWeight: 424.49274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4)SC1=S

Isomeric SMILES

CC(C(=O)O)N1C(=O)/C(=C/2\C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4)/SC1=S

InChI

InChI=1S/C21H16N2O4S2/c1-12(20(26)27)23-19(25)17(29-21(23)28)16-14-9-5-6-10-15(14)22(18(16)24)11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3,(H,26,27)/b17-16-