ethyl 2-(3-azanyl-2-cyano-3-oxidanylidene-propanethioyl)sulfanylethanoate

Systemtic Name: ethyl 2-(3-azanyl-2-cyano-3-oxidanylidene-propanethioyl)sulfanylethanoate Openeye Name: ethyl 2-(3-amino-2-cyano-3-oxo-propanethioyl)sulfanylacetate CAS Name: 2-[(3-amino-2-cyano-3-oxo-1-sulfanylidenepropyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(3-amino-2-cyano-3-oxopropanethioyl)sulfanylacetate Traditional Name: 2-[(3-amino-2-cyano-3-keto-propanethioyl)thio]acetic acid ethyl ester Formula: C8H10N2O3S2 MolecularWeight: 246.3066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=S)C(C#N)C(=O)N

Isomeric SMILES

CCOC(=O)CSC(=S)C(C#N)C(=O)N

InChI

InChI=1S/C8H10N2O3S2/c1-2-13-6(11)4-15-8(14)5(3-9)7(10)12/h5H,2,4H2,1H3,(H2,10,12)