sodium (E)-2-cyano-3-ethoxy-3-oxidanylidene-1-(prop-2-enylamino)prop-1-ene-1-thiolate

Systemtic Name: sodium (E)-2-cyano-3-ethoxy-3-oxidanylidene-1-(prop-2-enylamino)prop-1-ene-1-thiolate Openeye Name: sodium (E)-1-(allylamino)-2-cyano-3-ethoxy-3-oxo-prop-1-ene-1-thiolate CAS Name: sodium (E)-2-cyano-3-ethoxy-3-oxo-1-(prop-2-enylamino)-1-propene-1-thiolate IUPAC Name: sodium (E)-2-cyano-3-ethoxy-3-oxo-1-(prop-2-enylamino)prop-1-ene-1-thiolate Traditional Name: sodium (E)-1-(allylamino)-2-cyano-3-ethoxy-3-keto-prop-1-ene-1-thiolate Formula: C9H11N2NaO2S MolecularWeight: 234.25061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NCC=C)[S-])C#N.[Na+]

Isomeric SMILES

CCOC(=O)/C(=C(\NCC=C)/[S-])/C#N.[Na+]

InChI

InChI=1S/C9H12N2O2S.Na/c1-3-5-11-8(14)7(6-10)9(12)13-4-2;/h3,11,14H,1,4-5H2,2H3;/q;+1/p-1/b8-7+;