sodium [(Z)-2-cyano-3-methoxy-3-oxidanylidene-1-phenyl-prop-1-enyl]-ethanethioyl-azanide

Systemtic Name: sodium [(Z)-2-cyano-3-methoxy-3-oxidanylidene-1-phenyl-prop-1-enyl]-ethanethioyl-azanide Openeye Name: sodium [(Z)-2-cyano-3-methoxy-3-oxo-1-phenyl-prop-1-enyl]-ethanethioyl-azanide CAS Name: sodium [(Z)-2-cyano-3-methoxy-3-oxo-1-phenylprop-1-enyl]-(1-sulfanylideneethyl)azanide IUPAC Name: sodium [(Z)-2-cyano-3-methoxy-3-oxo-1-phenylprop-1-enyl]-ethanethioylazanide Traditional Name: sodium [(Z)-2-cyano-3-keto-3-methoxy-1-phenyl-prop-1-enyl]-thioacetyl-azanide Formula: C13H11N2NaO2S MolecularWeight: 282.29341

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)[N-]C(=C(C#N)C(=O)OC)C1=CC=CC=C1.[Na+]

Isomeric SMILES

CC(=S)[N-]/C(=C(/C#N)\C(=O)OC)/C1=CC=CC=C1.[Na+]

InChI

InChI=1S/C13H12N2O2S.Na/c1-9(18)15-12(10-6-4-3-5-7-10)11(8-14)13(16)17-2;/h3-7H,1-2H3,(H,15,16,18);/q;+1/p-1