ethyl 2-[(Z)-3-azanyl-2-cyano-3-oxidanylidene-1-sulfanyl-prop-1-enyl]sulfanylethanoate

Systemtic Name: ethyl 2-[(Z)-3-azanyl-2-cyano-3-oxidanylidene-1-sulfanyl-prop-1-enyl]sulfanylethanoate Openeye Name: ethyl 2-[(Z)-3-amino-2-cyano-3-oxo-1-sulfanyl-prop-1-enyl]sulfanylacetate CAS Name: 2-[[(Z)-3-amino-2-cyano-1-mercapto-3-oxoprop-1-enyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(Z)-3-amino-2-cyano-3-oxo-1-sulfanylprop-1-enyl]sulfanylacetate Traditional Name: 2-[[(Z)-3-amino-2-cyano-3-keto-1-mercapto-prop-1-enyl]thio]acetic acid ethyl ester Formula: C8H10N2O3S2 MolecularWeight: 246.3066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)CS/C(=C(/C#N)\C(=O)N)/S

InChI

InChI=1S/C8H10N2O3S2/c1-2-13-6(11)4-15-8(14)5(3-9)7(10)12/h14H,2,4H2,1H3,(H2,10,12)/b8-5-