11-[(5E)-5-[(1-methylpyrrol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoate

Systemtic Name: 11-[(5E)-5-[(1-methylpyrrol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoate Openeye Name: 11-[(5E)-5-[(1-methylpyrrol-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]undecanoate CAS Name: 11-[(5E)-5-[(1-methyl-3-pyrrolyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]undecanoate IUPAC Name: 11-[(5E)-5-[(1-methylpyrrol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoate Traditional Name: 11-[(5E)-4-keto-5-[(1-methylpyrrol-3-yl)methylene]-2-thioxo-thiazolidin-3-yl]undecanoate Formula: C20H27N2O3S2- MolecularWeight: 407.56998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)C=C2C(=O)N(C(=S)S2)CCCCCCCCCCC(=O)[O-]

Isomeric SMILES

CN1C=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)CCCCCCCCCCC(=O)[O-]

InChI

InChI=1S/C20H28N2O3S2/c1-21-13-11-16(15-21)14-17-19(25)22(20(26)27-17)12-9-7-5-3-2-4-6-8-10-18(23)24/h11,13-15H,2-10,12H2,1H3,(H,23,24)/p-1/b17-14+