Vitas-M small molecule compound
ethyl [(5Z)-5-(4-hydroxy-3-nitrobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STK059301
SMILES CCOC(=O)CN1C(=O)S/C(=C\c2ccc(c(c2)[N+](=O)[O-])O)/C1=O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C14H12N2O7S MW 352.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O7S/c1-2-23-12(18)7-15-13(19)11(24-14(15)20)6-8-3-4-10(17)9(5-8)16(21)22/h3-6,17H,2,7H2,1H3/b11-6-InChIKey
RYJPTMBHRBJJPC-WDZFZDKYSA-NSynonyms
CCOC(=O)CN1C(=O)C(=CC2=CC(=C(C=C2)O)(N+)(=O)(O))SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2ccc(c(c2)(N+)(=O)(O))O)C1=O
ETHYL((5Z)5(4HYDROXY3NITROBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
ETHYL2((5Z)5((4HYDROXY3NITROPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
InChI=1SC14H12N2O7Sc122312(18)71513(19)11(2414(15)20)683410(17)9(58)16(21)22h3617H27H21H3b116
MFCD04537672
STK059301
ZINC000013546613
ZINC13546613
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