5-[(2E)-2-(2-azanyl-4-methylidene-1,3-thiazol-5-ylidene)hydrazinyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(2E)-2-(2-azanyl-4-methylidene-1,3-thiazol-5-ylidene)hydrazinyl]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(2E)-2-(2-amino-4-methylene-thiazol-5-ylidene)hydrazino]benzene-1,3-dicarboxylic acid CAS Name: 5-[(2E)-2-(2-amino-4-methylene-5-thiazolylidene)hydrazinyl]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(2E)-2-(2-amino-4-methylidene-1,3-thiazol-5-ylidene)hydrazinyl]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(N'E)-N'-(2-amino-4-methylene-2-thiazolin-5-ylidene)hydrazino]isophthalic acid Formula: C12H10N4O4S MolecularWeight: 306.2972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C1C(=NNC2=CC(=CC(=C2)C(=O)O)C(=O)O)SC(=N1)N

Isomeric SMILES

C=C1/C(=N\NC2=CC(=CC(=C2)C(=O)O)C(=O)O)/SC(=N1)N

InChI

InChI=1S/C12H10N4O4S/c1-5-9(21-12(13)14-5)16-15-8-3-6(10(17)18)2-7(4-8)11(19)20/h2-4,15H,1H2,(H2,13,14)(H,17,18)(H,19,20)/b16-9+