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

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

Systemtic Name:methyl 2-(3-azanyl-2-cyano-3-oxidanylidene-propanethioyl)sulfanylethanoate
Openeye Name:methyl 2-(3-amino-2-cyano-3-oxo-propanethioyl)sulfanylacetate
CAS Name:2-[(3-amino-2-cyano-3-oxo-1-sulfanylidenepropyl)thio]acetic acid methyl ester
IUPAC Name:methyl 2-(3-amino-2-cyano-3-oxopropanethioyl)sulfanylacetate
Traditional Name:2-[(3-amino-2-cyano-3-keto-propanethioyl)thio]acetic acid methyl ester
Formula: C7H8N2O3S2
MolecularWeight: 232.28002
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C7H8N2O3S2/c1-12-5(10)3-14-7(13)4(2-8)6(9)11/h4H,3H2,1H3,(H2,9,11)


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