Vitas-M small molecule compound
5-(benzylsulfanyl)-3-[(4-bromobenzyl)sulfanyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Catalog ID
STK720383
SMILES Brc1ccc(cc1)CSc1nnc2n1c(SCc1ccccc1)nc1c2c2CCCCc2s1
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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 C25H21BrN4S3 MW 553.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrN4S3/c26-18-12-10-17(11-13-18)15-32-25-29-28-22-21-19-8-4-5-9-20(19)33-23(21)27-24(30(22)25)31-14-16-6-2-1-3-7-16/h1-3,6-7,10-13H,4-5,8-9,14-15H2InChIKey
LPGLSNWJAGYWRP-UHFFFAOYSA-NSynonyms
5(benzylsulfanyl)3((4bromobenzyl)sulfanyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidine
5(benzylthio)3((4bromobenzyl)thio)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidine
C1CCC2=C(C1)C3=C(S2)N=C(N4C3=NN=C4SCC5=CC=C(C=C5)Br)SCC6=CC=CC=C6
InChI=1SC25H21BrN4S3c2618121017(111318)1532252928222119845920(19)3323(21)2724(30(22)25)3114166213716h13671013H45891415H2
MFCD04008048
ZINC000001878088
ZINC01878088
ZINC1878088
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