sodium (Z)-3-(benzenecarbonothioylimino)-2-cyano-1-methoxy-3-phenyl-prop-1-en-1-olate

Systemtic Name: sodium (Z)-3-(benzenecarbonothioylimino)-2-cyano-1-methoxy-3-phenyl-prop-1-en-1-olate Openeye Name: sodium (Z)-3-(benzenecarbonothioylimino)-2-cyano-1-methoxy-3-phenyl-prop-1-en-1-olate CAS Name: sodium (Z)-3-(benzenecarbonothioylimino)-2-cyano-1-methoxy-3-phenyl-1-propen-1-olate IUPAC Name: sodium (Z)-3-(benzenecarbonothioylimino)-2-cyano-1-methoxy-3-phenylprop-1-en-1-olate Traditional Name: sodium (Z)-3-(benzenecarbonothioylimino)-2-cyano-1-methoxy-3-phenyl-prop-1-en-1-olate Formula: C18H13N2NaO2S MolecularWeight: 344.36279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C#N)C(=NC(=S)C1=CC=CC=C1)C2=CC=CC=C2)[O-].[Na+]

Isomeric SMILES

CO/C(=C(\C#N)/C(=NC(=S)C1=CC=CC=C1)C2=CC=CC=C2)/[O-].[Na+]

InChI

InChI=1S/C18H14N2O2S.Na/c1-22-18(21)15(12-19)16(13-8-4-2-5-9-13)20-17(23)14-10-6-3-7-11-14;/h2-11,21H,1H3;/q;+1/p-1/b18-15+,20-16?;