Vitas-M small molecule compound
2-bromo-4-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-6-methoxyphenyl 2-chlorobenzoate
Catalog ID
STL384000
SMILES COc1cc(/C=C/2\SC(=N)NC2=O)cc(c1OC(=O)c1ccccc1Cl)Br
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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 C18H12BrClN2O4S MW 467.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrClN2O4S/c1-25-13-7-9(8-14-16(23)22-18(21)27-14)6-11(19)15(13)26-17(24)10-4-2-3-5-12(10)20/h2-8H,1H3,(H2,21,22,23)/b14-8-InChIKey
GQTKNLBFQFFSHI-ZSOIEALJSA-NSynonyms
(4((Z)(2AMINO4OXO13THIAZOL5YLIDENE)METHYL)2BROMO6METHOXYPHENYL)2CHLOROBENZOATE
2bromo4((Z)(2imino4oxo13thiazolidin5ylidene)methyl)6methoxyphenyl2chlorobenzoate
COC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)N)Br)OC(=O)C3=CC=CC=C3Cl
COc1cc(C=C2SC(=N)NC2=O)cc(c1OC(=O)c1ccccc1Cl)Br
InChI=1SC18H12BrClN2O4Sc1251379(81416(23)2218(21)2714)611(19)15(13)2617(24)10423512(10)20h28H1H3(H2212223)b148
MFCD02896732
ZINC000016213363
ZINC16213363
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