sodium (E)-2-cyano-3-[(4-methylphenyl)amino]-1-methylsulfanyl-3-oxidanylidene-prop-1-ene-1-thiolate

Systemtic Name: sodium (E)-2-cyano-3-[(4-methylphenyl)amino]-1-methylsulfanyl-3-oxidanylidene-prop-1-ene-1-thiolate Openeye Name: sodium (E)-2-cyano-3-(4-methylanilino)-1-methylsulfanyl-3-oxo-prop-1-ene-1-thiolate CAS Name: sodium (E)-2-cyano-3-(4-methylanilino)-1-(methylthio)-3-oxo-1-propene-1-thiolate IUPAC Name: sodium (E)-2-cyano-3-(4-methylanilino)-1-methylsulfanyl-3-oxoprop-1-ene-1-thiolate Traditional Name: sodium (E)-2-cyano-3-keto-1-(methylthio)-3-(p-toluidino)prop-1-ene-1-thiolate Formula: C12H11N2NaOS2 MolecularWeight: 286.34831

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=C([S-])SC)C#N.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)/C(=C(\[S-])/SC)/C#N.[Na+]

InChI

InChI=1S/C12H12N2OS2.Na/c1-8-3-5-9(6-4-8)14-11(15)10(7-13)12(16)17-2;/h3-6,16H,1-2H3,(H,14,15);/q;+1/p-1/b12-10+;