Vitas-M small molecule compound
7-[(2,4-dichlorobenzyl)sulfanyl]-12-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Catalog ID
STK720699
SMILES CC1CCc2c(C1)c1c(s2)n2c(SCc3ccc(cc3Cl)Cl)nnc2n2c1ncn2
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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 C20H16Cl2N6S2 MW 475.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16Cl2N6S2/c1-10-2-5-15-13(6-10)16-17-23-9-24-28(17)19-25-26-20(27(19)18(16)30-15)29-8-11-3-4-12(21)7-14(11)22/h3-4,7,9-10H,2,5-6,8H2,1H3InChIKey
BUKYAETXWDAVIQ-UHFFFAOYSA-NSynonyms
862199-95-97((24dichlorobenzyl)sulfanyl)12methyl10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidine
7((24dichlorobenzyl)thio)12methyl10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidine
862199959
CC1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC5=C(C=C(C=C5)Cl)Cl)N6C3=NC=N6
InChI=1SC20H16Cl2N6S2c110251513(610)16172392428(17)19252620(27(19)18(16)3015)298113412(21)714(11)22h347910H2568H21H3
MFCD05697289
ZINC000009292029
ZINC000009292030
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