ethyl (E)-3-[(E)-3-azanyl-2-cyano-1-methylsulfanyl-3-oxidanylidene-prop-1-enyl]sulfanylprop-2-enoate

Systemtic Name: ethyl (E)-3-[(E)-3-azanyl-2-cyano-1-methylsulfanyl-3-oxidanylidene-prop-1-enyl]sulfanylprop-2-enoate Openeye Name: ethyl (E)-3-[(E)-3-amino-2-cyano-1-methylsulfanyl-3-oxo-prop-1-enyl]sulfanylprop-2-enoate CAS Name: (E)-3-[[(E)-3-amino-2-cyano-1-(methylthio)-3-oxoprop-1-enyl]thio]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(E)-3-amino-2-cyano-1-methylsulfanyl-3-oxoprop-1-enyl]sulfanylprop-2-enoate Traditional Name: (E)-3-[[(E)-3-amino-2-cyano-3-keto-1-(methylthio)prop-1-enyl]thio]acrylic acid ethyl ester Formula: C10H12N2O3S2 MolecularWeight: 272.34388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O3S2/c1-3-15-8(13)4-5-17-10(16-2)7(6-11)9(12)14/h4-5H,3H2,1-2H3,(H2,12,14)/b5-4+,10-7+