Vitas-M small molecule compound
8-[(3,4-dichlorobenzyl)sulfanyl]-2,3-dimethyl-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one
Catalog ID
STK531345
SMILES Clc1cc(ccc1Cl)CSc1nnc2n1c1sc(c(c1c(=O)n2c1ccccc1)C)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 C22H16Cl2N4OS2 MW 487.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16Cl2N4OS2/c1-12-13(2)31-20-18(12)19(29)27(15-6-4-3-5-7-15)21-25-26-22(28(20)21)30-11-14-8-9-16(23)17(24)10-14/h3-10H,11H2,1-2H3InChIKey
MSKSIONDXBLWNK-UHFFFAOYSA-NSynonyms
8((34dichlorobenzyl)sulfanyl)23dimethyl5phenylthieno(32e)(124)triazolo(43a)pyrimidin4(5H)one
8((34dichlorobenzyl)thio)23dimethyl5phenylthieno(32e)(124)triazolo(43a)pyrimidin4(5H)one
CC1=C(SC2=C1C(=O)N(C3=NN=C(N23)SCC4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5)C
InChI=1SC22H16Cl2N4OS2c11213(2)312018(12)19(29)27(156435715)21252622(28(20)21)3011148916(23)17(24)1014h310H11H212H3
MFCD02987679
ZINC000002375660
ZINC02375660
ZINC2375660
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