SpectraBase Spectrum ID |
1ItcmfgaHI |
Name |
2-[[(E)-3-amino-2-cyano-1-mercapto-3-oxoprop-1-enyl]thio]acetic acid ethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C8H10N2O3S2 |
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+ |
InChIKey |
TZWIZDDTNAWSSE-VMPITWQZSA-N |
Molecular Weight |
246.299 g/mol |
SMILES |
S\C(=C/(C(=O)N)C#N)SCC(=O)OCC |
SPLASH |
splash10-003u-9500000000-20459490d12fa645e25a |
Synonyms |
2-[[(E)-3-amino-2-cyano-3-keto-1-mercapto-prop-1-enyl]thio]acetic acid ethyl ester
Ethyl 2-[(E)-3-amino-2-cyano-3-oxo-1-sulfanyl-prop-1-enyl]sulfanylacetate
Ethyl 2-[(E)-3-azanyl-2-cyano-3-oxidanylidene-1-sulfanyl-prop-1-enyl]sulfanylethanoate |
Wiley ID |
1451857 |