Vitas-M small molecule compound
methyl 4-{[({5-[(4-methoxybenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]amino}benzoate
Catalog ID
STK025787
SMILES COc1ccc(cc1)CSc1nnc(s1)SCC(=O)Nc1ccc(cc1)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 C20H19N3O4S3 MW 461.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O4S3/c1-26-16-9-3-13(4-10-16)11-28-19-22-23-20(30-19)29-12-17(24)21-15-7-5-14(6-8-15)18(25)27-2/h3-10H,11-12H2,1-2H3,(H,21,24)InChIKey
RLWWUHSWRCYQBH-UHFFFAOYSA-NSynonyms
499103-72-9499103729
COC1=CC=C(C=C1)CSC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)C(=O)OC
COc1ccc(cc1)CSc1nnc(s1)SCC(=O)Nc1ccc(cc1)C(=O)OC
InChI=1SC20H19N3O4S3c126169313(41016)112819222320(3019)291217(24)21157514(6815)18(25)272h310H1112H212H3(H2124)
METHYL4((((5((4METHOXYBENZYL)SULFANYL)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((2((5((4METHOXYPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4(2((5(((4METHOXYPHENYL)METHYL)SULFANYL)134THIADIAZOL2YL)SULFANYL)ACETAMIDO)BENZOATE
methyl4(2((5((4methoxybenzyl)thio)134thiadiazol2yl)thio)acetamido)benzoate
METHYL4(2(5((4METHOXYPHENYL)METHYLTHIO)134THIADIAZOL2YLTHIO)ACETYLAMINO)BENZOATE
MFCD03224094
STK025787
ZINC000001796037
ZINC01796037
ZINC1796037
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.