Vitas-M small molecule compound
2-bromo-4-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-6-methoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STL382806
SMILES COc1cc(/C=C/2\SC(=N)NC2=O)cc(c1OS(=O)(=O)c1ccc(cc1)C)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 C18H15BrN2O5S2 MW 483.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15BrN2O5S2/c1-10-3-5-12(6-4-10)28(23,24)26-16-13(19)7-11(8-14(16)25-2)9-15-17(22)21-18(20)27-15/h3-9H,1-2H3,(H2,20,21,22)/b15-9-InChIKey
BCMOSZDNPANEDY-DHDCSXOGSA-NSynonyms
(4((Z)(2AMINO4OXO13THIAZOL5YLIDENE)METHYL)2BROMO6METHOXYPHENYL)4METHYLBENZENESULFONATE
2bromo4((Z)(2imino4oxo13thiazolidin5ylidene)methyl)6methoxyphenyl4methylbenzenesulfonate
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C=C3C(=O)N=C(S3)N)OC
COc1cc(C=C2SC(=N)NC2=O)cc(c1OS(=O)(=O)c1ccc(cc1)C)Br
InChI=1SC18H15BrN2O5S2c1103512(6410)28(2324)261613(19)711(814(16)252)91517(22)2118(20)2715h39H12H3(H2202122)b159
MFCD02215573
ZINC000015746209
ZINC15746209
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