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

Systemtic Name: 2-[5-(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenyl-propanoic acid Openeye Name: 2-[5-(5-bromo-2-oxo-indolin-3-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-3-phenyl-propanoic acid CAS Name: 2-[5-(5-bromo-2-oxo-1H-indol-3-ylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-phenylpropanoic acid IUPAC Name: 2-[5-(5-bromo-2-oxo-1H-indol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid Traditional Name: 2-[5-(5-bromo-2-keto-indolin-3-ylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-3-phenyl-propionic acid Formula: C20H13BrN2O4S2 MolecularWeight: 489.36222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C(=C3C4=C(C=CC(=C4)Br)NC3=O)SC2=S

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C(=C3C4=C(C=CC(=C4)Br)NC3=O)SC2=S

InChI

InChI=1S/C20H13BrN2O4S2/c21-11-6-7-13-12(9-11)15(17(24)22-13)16-18(25)23(20(28)29-16)14(19(26)27)8-10-4-2-1-3-5-10/h1-7,9,14H,8H2,(H,22,24)(H,26,27)