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Methyl (Z)-2-((E)-3-ethyl-2-{(E)-[(Z)-5-(2-methoxy-2-oxoethylidene)-4-oxo-3-phenylthiazolidin-2-ylidene]hydrazono}-4-oxothiazolidin-5-ylidene}acetate
SpectraBase Compound ID 2RvJu1zSMsG
InChI InChI=1S/C20H18N4O6S2/c1-4-23-17(27)13(10-15(25)29-2)31-19(23)21-22-20-24(12-8-6-5-7-9-12)18(28)14(32-20)11-16(26)30-3/h5-11H,4H2,1-3H3/b13-10+,14-11-,21-19+,22-20-
InChIKey GHGRWEDVDDPKOD-FAABEKKRSA-N
Mol Weight 474.51 g/mol
Molecular Formula C20H18N4O6S2
Exact Mass 474.066777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1vTGFdJycHs
Name Methyl (Z)-2-((E)-3-ethyl-2-{(E)-[(Z)-5-(2-methoxy-2-oxoethylidene)-4-oxo-3-phenylthiazolidin-2-ylidene]hydrazono}-4-oxothiazolidin-5-ylidene}acetate
Comments Computed using HOSE algorithm
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Exact Mass 474.066776658 u
Formula C20H18N4O6S2
InChI InChI=1S/C20H18N4O6S2/c1-4-23-17(27)13(10-15(25)29-2)31-19(23)21-22-20-24(12-8-6-5-7-9-12)18(28)14(32-20)11-16(26)30-3/h5-11H,4H2,1-3H3/b13-10+,14-11-,21-19+,22-20-
InChIKey GHGRWEDVDDPKOD-FAABEKKRSA-N
Molecular Weight 474.506 g/mol
SMILES C1(\C(S\C(N1C=1C=CC=CC1)=N\N=C/1N(C(=O)\C(S1)=C/C(=O)OC)CC)=C\C(=O)OC)=O