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

Systemtic Name: 5-[2-(4-azanyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)hydrazinyl]-2-chloranyl-benzoic acid Openeye Name: 5-[2-(4-amino-6-oxo-2-thioxo-pyrimidin-5-ylidene)hydrazino]-2-chloro-benzoic acid CAS Name: 5-[2-(4-amino-6-oxo-2-sulfanylidene-5-pyrimidinylidene)hydrazinyl]-2-chlorobenzoic acid IUPAC Name: 5-[2-(4-amino-6-oxo-2-sulfanylidenepyrimidin-5-ylidene)hydrazinyl]-2-chlorobenzoic acid Traditional Name: 5-[N'-(4-amino-6-keto-2-thioxo-pyrimidin-5-ylidene)hydrazino]-2-chloro-benzoic acid Formula: C11H8ClN5O3S MolecularWeight: 325.73092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NN=C2C(=NC(=S)NC2=O)N)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1NN=C2C(=NC(=S)NC2=O)N)C(=O)O)Cl

InChI

InChI=1S/C11H8ClN5O3S/c12-6-2-1-4(3-5(6)10(19)20)16-17-7-8(13)14-11(21)15-9(7)18/h1-3,16H,(H,19,20)(H3,13,14,15,18,21)