Vitas-M small molecule compound
methyl 3-{[4-chloro-5-{(E)-[2-(cyanoacetyl)hydrazinylidene]methyl}-2-oxo-1,3-thiazol-3(2H)-yl]methyl}benzoate
Catalog ID
STL239933
SMILES N#CCC(=O)N/N=C/c1sc(=O)n(c1Cl)Cc1cccc(c1)C(=O)OC
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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 C16H13ClN4O4S MW 392.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN4O4S/c1-25-15(23)11-4-2-3-10(7-11)9-21-14(17)12(26-16(21)24)8-19-20-13(22)5-6-18/h2-4,7-8H,5,9H2,1H3,(H,20,22)/b19-8+InChIKey
SRAYLDYWQGQZBR-UFWORHAWSA-NSynonyms
609790-98-9(E)methyl3((4chloro5((2(2cyanoacetyl)hydrazono)methyl)2oxothiazol3(2H)yl)methyl)benzoate
609790989
COC(=O)C1=CC(=CC=C1)CN2C(=C(SC2=O)C=NNC(=O)CC#N)Cl
InChI=1SC16H13ClN4O4Sc12515(23)1142310(711)92114(17)12(2616(21)24)8192013(22)5618h2478H59H21H3(H2022)b198+
METHYL3((4CHLORO5((E)((2CYANOACETYL)HYDRAZINYLIDENE)METHYL)2OXO13THIAZOL3YL)METHYL)BENZOATE
methyl3((4chloro5((E)(2(cyanoacetyl)hydrazinylidene)methyl)2oxo13thiazol3(2H)yl)methyl)benzoate
MFCD03682956
N#CCC(=O)NN=Cc1sc(=O)n(c1Cl)Cc1cccc(c1)C(=O)OC
ZINC000002238622
ZINC33351370
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