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(2Z,2'E)-dimethyl-2,2'-[(2Z,2'Z)-3,3'-(ethane-1,2-diyl)bis-(2-ethylimino)-4-oxothiazolidin-3-yl-5-ylidene]diacetate
SpectraBase Compound ID 1IkN4jRenWn
InChI InChI=1S/C18H22N4O6S2/c1-5-19-17-21(15(25)11(29-17)9-13(23)27-3)7-8-22-16(26)12(10-14(24)28-4)30-18(22)20-6-2/h9-10H,5-8H2,1-4H3/b11-9-,12-10+,19-17-,20-18-
InChIKey FMLNGVVMPKUZOP-LYAKZCFHSA-N
Mol Weight 454.52 g/mol
Molecular Formula C18H22N4O6S2
Exact Mass 454.098077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 53LEAeArs0v
Name (2Z,2'E)-dimethyl-2,2'-[(2Z,2'Z)-3,3'-(ethane-1,2-diyl)bis-(2-ethylimino)-4-oxothiazolidin-3-yl-5-ylidene]diacetate
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Formula C18H22N4O6S2
InChI InChI=1S/C18H22N4O6S2/c1-5-19-17-21(15(25)11(29-17)9-13(23)27-3)7-8-22-16(26)12(10-14(24)28-4)30-18(22)20-6-2/h9-10H,5-8H2,1-4H3/b11-9-,12-10+,19-17-,20-18-
InChIKey FMLNGVVMPKUZOP-LYAKZCFHSA-N
Molecular Weight 454.516 g/mol
SMILES C(\N=C\1N(CCN2C(=O)\C(=C/C(=O)OC)S\C2=N\CC)C(=O)\C(=C\C(=O)OC)S1)C
SPLASH splash10-0f6x-0090700000-32d90b6a6d554028297c
Source of Spectrum ZNB-70-245-3a
Synonyms Dimethyl 2,2'-((2Z,2'Z)-ethane-1,2-diylbis(2-(ethylimino)-4-oxothiazolidin-3-yl-5-ylidene))(2Z,2'E)-diacetate
Wiley ID 1806131