2-[2-(4-azanyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)hydrazinyl]benzoic acid

Systemtic Name: 2-[2-(4-azanyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)hydrazinyl]benzoic acid Openeye Name: 2-[2-(4-amino-6-oxo-2-thioxo-pyrimidin-5-ylidene)hydrazino]benzoic acid CAS Name: 2-[2-(4-amino-6-oxo-2-sulfanylidene-5-pyrimidinylidene)hydrazinyl]benzoic acid IUPAC Name: 2-[2-(4-amino-6-oxo-2-sulfanylidenepyrimidin-5-ylidene)hydrazinyl]benzoic acid Traditional Name: 2-[N'-(4-amino-6-keto-2-thioxo-pyrimidin-5-ylidene)hydrazino]benzoic acid Formula: C11H9N5O3S MolecularWeight: 291.28586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NN=C2C(=NC(=S)NC2=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NN=C2C(=NC(=S)NC2=O)N

InChI

InChI=1S/C11H9N5O3S/c12-8-7(9(17)14-11(20)13-8)16-15-6-4-2-1-3-5(6)10(18)19/h1-4,15H,(H,18,19)(H3,12,13,14,17,20)