methyl 3-azanyl-2-cyano-3-oxidanylidene-N-prop-2-enyl-propanimidothioate

Systemtic Name: methyl 3-azanyl-2-cyano-3-oxidanylidene-N-prop-2-enyl-propanimidothioate Openeye Name: methyl N-allyl-3-amino-2-cyano-3-oxo-propanimidothioate CAS Name: 3-amino-2-cyano-3-oxo-N-prop-2-enylpropanimidothioic acid methyl ester IUPAC Name: methyl 3-amino-2-cyano-3-oxo-N-prop-2-enylpropanimidothioate Traditional Name: N-allyl-3-amino-2-cyano-3-keto-thiopropionimidic acid methyl ester Formula: C8H11N3OS MolecularWeight: 197.25744

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCC=C)C(C#N)C(=O)N

Isomeric SMILES

CSC(=NCC=C)C(C#N)C(=O)N

InChI

InChI=1S/C8H11N3OS/c1-3-4-11-8(13-2)6(5-9)7(10)12/h3,6H,1,4H2,2H3,(H2,10,12)