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3-[5-[(E)-(2-imino-4-keto-3-thiazol-2-yl-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid
SpectraBase Compound ID 18ZB87WfUFT
InChI InChI=1S/C18H11N3O4S2/c19-17-21(18-20-6-7-26-18)15(22)14(27-17)9-12-4-5-13(25-12)10-2-1-3-11(8-10)16(23)24/h1-9,19H,(H,23,24)/b14-9+,19-17?
InChIKey OOGTVZNCVOYMHJ-IBEXDWOESA-N
Mol Weight 397.42 g/mol
Molecular Formula C18H11N3O4S2
Exact Mass 397.019098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JU51R3C4e6R
Name 3-[5-[(E)-(2-imino-4-keto-3-thiazol-2-yl-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid
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Formula C18H11N3O4S2
InChI InChI=1S/C18H11N3O4S2/c19-17-21(18-20-6-7-26-18)15(22)14(27-17)9-12-4-5-13(25-12)10-2-1-3-11(8-10)16(23)24/h1-9,19H,(H,23,24)/b14-9+,19-17?
InChIKey OOGTVZNCVOYMHJ-IBEXDWOESA-N
Molecular Weight 397.423 g/mol
SMILES OC(c1cc(-c2oc(\C=C/3C(N(C(S3)=N)c3nccs3)=O)cc2)ccc1)=O
SPLASH splash10-002f-6972000000-d76cadbdbffe36e15aa8
Synonyms 3-[5-[(E)-(2-imino-4-oxo-3-thiazol-2-yl-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid 3-[5-[(E)-[2-azanylidene-4-oxidanylidene-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid 3-[5-[(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid 3-[5-[(E)-[2-imino-4-oxo-3-(2-thiazolyl)-5-thiazolidinylidene]methyl]-2-furanyl]benzoic acid
Wiley ID 1460396