gold(1+); 3-(prop-2-enylcarbamothioylamino)benzoate; sodium

Systemtic Name: gold(1+); 3-(prop-2-enylcarbamothioylamino)benzoate; sodium Openeye Name: 3-(allylcarbamothioylamino)benzoate; gold(1+); sodium CAS Name: gold(1+); 3-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]benzoate; sodium IUPAC Name: gold(1+); 3-(prop-2-enylcarbamothioylamino)benzoate; sodium Traditional Name: 3-(allylthiocarbamoylamino)benzoate; gold(1+); sodium Formula: C11H11AuN2NaO2S MolecularWeight: 455.23856

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=CC=CC(=C1)C(=O)[O-].[Na].[Au+]

Isomeric SMILES

C=CCNC(=S)NC1=CC=CC(=C1)C(=O)[O-].[Na].[Au+]

InChI

InChI=1S/C11H12N2O2S.Au.Na/c1-2-6-12-11(16)13-9-5-3-4-8(7-9)10(14)15;;/h2-5,7H,1,6H2,(H,14,15)(H2,12,13,16);;/q;+1;/p-1