disodium 2-[[4-(3-sulfanidyl-1,2,4-triazol-4-yl)phenyl]amino]ethanoate

Systemtic Name: disodium 2-[[4-(3-sulfanidyl-1,2,4-triazol-4-yl)phenyl]amino]ethanoate Openeye Name: disodium 2-[4-(3-sulfido-1,2,4-triazol-4-yl)anilino]acetate CAS Name: disodium 2-[4-(3-sulfido-1,2,4-triazol-4-yl)anilino]acetate IUPAC Name: disodium 2-[4-(3-sulfido-1,2,4-triazol-4-yl)anilino]acetate Traditional Name: disodium 2-[4-(3-sulfido-1,2,4-triazol-4-yl)anilino]acetate Formula: C10H8N4Na2O2S MolecularWeight: 294.24066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC(=O)[O-])N2C=NN=C2[S-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1NCC(=O)[O-])N2C=NN=C2[S-].[Na+].[Na+]

InChI

InChI=1S/C10H10N4O2S.2Na/c15-9(16)5-11-7-1-3-8(4-2-7)14-6-12-13-10(14)17;;/h1-4,6,11H,5H2,(H,13,17)(H,15,16);;/q;2*+1/p-2