Vitas-M small molecule compound
4-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-chloro-6-methoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STK091513
SMILES COc1cc(/C=C\2/SC(=S)N(C2=O)Cc2ccccc2)cc(c1OS(=O)(=O)c1ccc(cc1)C)Cl
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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 C25H20ClNO5S3 MW 546.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClNO5S3/c1-16-8-10-19(11-9-16)35(29,30)32-23-20(26)12-18(13-21(23)31-2)14-22-24(28)27(25(33)34-22)15-17-6-4-3-5-7-17/h3-14H,15H2,1-2H3/b22-14+InChIKey
FVEGYGNQACCXNX-HYARGMPZSA-NSynonyms
(4((E)(3BENZYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2CHLORO6METHOXYPHENYL)4METHYLBENZENESULFONATE
4((E)(3BENZYL4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)2CHLORO6METHOXYPHENYL4METHYLBENZENESULFONATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)OC
COc1cc(C=C2SC(=S)N(C2=O)Cc2ccccc2)cc(c1OS(=O)(=O)c1ccc(cc1)C)Cl
InChI=1SC25H20ClNO5S3c11681019(11916)35(2930)322320(26)1218(1321(23)312)142224(28)27(25(33)3422)15176435717h314H15H212H3b2214+
MFCD02122467
STK091513
ZINC000002962682
ZINC2962682
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