4-azanylidene-1-phenyl-5-sulfanylidene-pyrrole-2,3-dicarboxylic acid

Systemtic Name: 4-azanylidene-1-phenyl-5-sulfanylidene-pyrrole-2,3-dicarboxylic acid Openeye Name: 4-imino-1-phenyl-5-thioxo-pyrrole-2,3-dicarboxylic acid CAS Name: 4-imino-1-phenyl-5-sulfanylidenepyrrole-2,3-dicarboxylic acid IUPAC Name: 4-imino-1-phenyl-5-sulfanylidenepyrrole-2,3-dicarboxylic acid Traditional Name: 4-imino-1-phenyl-5-thioxo-2-pyrroline-2,3-dicarboxylic acid Formula: C12H8N2O4S MolecularWeight: 276.26792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N)C2=S)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N)C2=S)C(=O)O)C(=O)O

InChI

InChI=1S/C12H8N2O4S/c13-8-7(11(15)16)9(12(17)18)14(10(8)19)6-4-2-1-3-5-6/h1-5,13H,(H,15,16)(H,17,18)