gold(1+); methyl 3-acetamido-5-(3-sulfanidylsulfonyl-1,2,4-triazol-4-yl)benzoate; sodium

Systemtic Name: gold(1+); methyl 3-acetamido-5-(3-sulfanidylsulfonyl-1,2,4-triazol-4-yl)benzoate; sodium Openeye Name: gold(1+); methyl 3-acetamido-5-(3-sulfidosulfonyl-1,2,4-triazol-4-yl)benzoate; sodium CAS Name: 3-acetamido-5-(3-sulfidosulfonyl-1,2,4-triazol-4-yl)benzoic acid methyl ester; gold(1+); sodium IUPAC Name: gold(1+); methyl 3-acetamido-5-(3-sulfidosulfonyl-1,2,4-triazol-4-yl)benzoate; sodium Traditional Name: 3-acetamido-5-(3-sulfidosulfonyl-1,2,4-triazol-4-yl)benzoic acid methyl ester; gold(1+); sodium Formula: C12H11AuN4NaO5S2 MolecularWeight: 575.32586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)N2C=NN=C2S(=O)(=O)[S-])C(=O)OC.[Na].[Au+]

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)N2C=NN=C2S(=O)(=O)[S-])C(=O)OC.[Na].[Au+]

InChI

InChI=1S/C12H12N4O5S2.Au.Na/c1-7(17)14-9-3-8(11(18)21-2)4-10(5-9)16-6-13-15-12(16)23(19,20)22;;/h3-6H,1-2H3,(H,14,17)(H,19,20,22);;/q;+1;/p-1