2-[2-[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]hydrazinyl]benzoic acid

Systemtic Name: 2-[2-[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]hydrazinyl]benzoic acid Openeye Name: 2-[2-(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)hydrazino]benzoic acid CAS Name: 2-[2-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzoic acid IUPAC Name: 2-[2-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzoic acid Traditional Name: 2-[N'-(4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)hydrazino]benzoic acid Formula: C11H8N4O4S MolecularWeight: 292.27062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8N4O4S/c16-8-7(9(17)13-11(20)12-8)15-14-6-4-2-1-3-5(6)10(18)19/h1-4,14H,(H,18,19)(H2,12,13,16,17,20)