Vitas-M small molecule compound
2-methoxy-6-nitro-4-[(Z)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
Catalog ID
STK754584
SMILES COc1cc(/C=C/2\SC(=S)NC2=O)cc(c1OC(=O)C)[N+](=O)[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 C13H10N2O6S2 MW 354.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10N2O6S2/c1-6(16)21-11-8(15(18)19)3-7(4-9(11)20-2)5-10-12(17)14-13(22)23-10/h3-5H,1-2H3,(H,14,17,22)/b10-5-InChIKey
KQHAMBYKDNOGSC-YHYXMXQVSA-NSynonyms
(2METHOXY6NITRO4((Z)(4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)ACETATE
2methoxy6nitro4((Z)(4oxo2thioxo13thiazolidin5ylidene)methyl)phenylacetate
CC(=O)OC1=C(C=C(C=C1OC)C=C2C(=O)NC(=S)S2)(N+)(=O)(O)
COc1cc(C=C2SC(=S)NC2=O)cc(c1OC(=O)C)(N+)(=O)(O)
InChI=1SC13H10N2O6S2c16(16)21118(15(18)19)37(49(11)202)51012(17)1413(22)2310h35H12H3(H141722)b105
MFCD00826154
ZINC000012364577
ZINC12364577
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