Vitas-M small molecule compound

2-({5-[(4-methoxybenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide

Catalog ID
STK036821
SMILES COc1ccc(cc1)CSc1nnc(s1)SCC(=O)Nc1c(C)cc(cc1C)C

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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 C21H23N3O2S3 MW 445.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O2S3/c1-13-9-14(2)19(15(3)10-13)22-18(25)12-28-21-24-23-20(29-21)27-11-16-5-7-17(26-4)8-6-16/h5-10H,11-12H2,1-4H3,(H,22,25)
InChIKey
IZBFUQDQMKKPPU-UHFFFAOYSA-N
Synonyms
499103-94-5
2((5(((4METHOXYPHENYL)METHYL)SULFANYL)134THIADIAZOL2YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
2((5((4METHOXYBENZYL)SULFANYL)134THIADIAZOL2YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
2((5((4METHOXYPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
2(5((4METHOXYPHENYL)METHYLTHIO)(134THIADIAZOL2YLTHIO))N(246TRIMETHYLPHENYL)ACETAMIDE
499103945
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NN=C(S2)SCC3=CC=C(C=C3)OC)C
COc1ccc(cc1)CSc1nnc(s1)SCC(=O)Nc1c(C)cc(cc1C)C
InChI=1SC21H23N3O2S3c113914(2)19(15(3)1013)2218(25)122821242320(2921)2711165717(264)8616h510H1112H214H3(H2225)
MFCD03224132
Nmesityl2((5((4methoxybenzyl)thio)134thiadiazol2yl)thio)acetamide
STK036821
ZINC000001303289
ZINC01303289
ZINC1303289

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.