Vitas-M small molecule compound
methyl (2E)-{(2Z)-2-[1-cyano-2-(methylamino)-2-oxoethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene}ethanoate
Catalog ID
STK867573
SMILES COC(=O)/C=c\1/s/c(=C(\C(=O)NC)/C#N)/n(c1=O)c1ccccc1
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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 C16H13N3O4S MW 343.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O4S/c1-18-14(21)11(9-17)16-19(10-6-4-3-5-7-10)15(22)12(24-16)8-13(20)23-2/h3-8H,1-2H3,(H,18,21)/b12-8+,16-11-InChIKey
DWOXOLJEIWWYBF-VRDXCEGKSA-NSynonyms
799824-56-9(2(1CYANO1METHYLCARBAMOYLMETH(Z)YLIDENE)4OXO3PHENYLTHIAZOLIDIN(5E)YLIDENE)ACETICACIDMETHYLESTER
(E)methyl2((Z)2(1cyano2(methylamino)2oxoethylidene)4oxo3phenylthiazolidin5ylidene)acetate
799824569
CNC(=O)C(=C1N(C(=O)C(=CC(=O)OC)S1)C2=CC=CC=C2)C#N
COC(=O)C=c1sc(=C(C(=O)NC)C#N)n(c1=O)c1ccccc1
InChI=1SC16H13N3O4Sc11814(21)11(917)1619(106435710)15(22)12(2416)813(20)232h38H12H3(H1821)b128+1611
methyl(2E)((2Z)2(1cyano2(methylamino)2oxoethylidene)4oxo3phenyl13thiazolidin5ylidene)ethanoate
METHYL(2E)2((2Z)2(1CYANO2(METHYLAMINO)2OXOETHYLIDENE)4OXO3PHENYL13THIAZOLIDIN5YLIDENE)ACETATE
METHYL2(2(CYANO(NMETHYLCARBAMOYL)METHYLENE)4OXO3PHENYL13THIAZOLIDIN5YLIDENE)ACETATE
MFCD03682740
ZINC000005034788
ZINC05034788
ZINC5034788
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