Vitas-M small molecule compound
3,7-bis[(4-methoxybenzyl)sulfanyl]-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Catalog ID
STK542980
SMILES COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2c(SCc2ccc(cc2)OC)nn1)CCCC3
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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 C28H26N6O2S3 MW 574.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N6O2S3/c1-35-19-11-7-17(8-12-19)15-37-27-31-29-24-23-21-5-3-4-6-22(21)39-25(23)34-26(33(24)27)30-32-28(34)38-16-18-9-13-20(36-2)14-10-18/h7-14H,3-6,15-16H2,1-2H3InChIKey
DELWNAPBTWFRPF-UHFFFAOYSA-NSynonyms
37bis((4methoxybenzyl)sulfanyl)10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a43c)pyrimidine
37bis((4methoxybenzyl)thio)10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a43c)pyrimidine
COC1=CC=C(C=C1)CSC2=NN=C3N2C4=C(C5=C(S4)CCCC5)C6=NN=C(N63)SCC7=CC=C(C=C7)OC
InChI=1SC28H26N6O2S3c1351911717(81219)1537273129242321534622(21)3925(23)3426(33(24)27)303228(34)38161891320(362)141018h714H361516H212H3
MFCD03297888
ZINC000002586832
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