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

Systemtic Name: 3-[4-oxidanylidene-5-(2-oxidanylidene-1-pentyl-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[4-oxo-5-(2-oxo-1-pentyl-indolin-3-ylidene)-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[4-oxo-5-(2-oxo-1-pentyl-3-indolylidene)-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[4-oxo-5-(2-oxo-1-pentylindol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[5-(1-amyl-2-keto-indolin-3-ylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=C3C(=O)N(C(=S)S3)CCC(=O)O)C1=O

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(=C3C(=O)N(C(=S)S3)CCC(=O)O)C1=O

InChI

InChI=1S/C19H20N2O4S2/c1-2-3-6-10-20-13-8-5-4-7-12(13)15(17(20)24)16-18(25)21(19(26)27-16)11-9-14(22)23/h4-5,7-8H,2-3,6,9-11H2,1H3,(H,22,23)