Vitas-M small molecule compound
2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-9-benzyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK541396
SMILES c1ccc(cc1)CN1CCc2c(C1)sc1c2c2nc(nn2cn1)CSc1nc2c(o1)cccc2
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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 C25H20N6OS2 MW 484.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N6OS2/c1-2-6-16(7-3-1)12-30-11-10-17-20(13-30)34-24-22(17)23-28-21(29-31(23)15-26-24)14-33-25-27-18-8-4-5-9-19(18)32-25/h1-9,15H,10-14H2InChIKey
YSQQLWOWWMLXPH-UHFFFAOYSA-NSynonyms
487037-62-72(((9benzyl891011tetrahydropyrido(4345)thieno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)thio)benzo(d)oxazole
2((13benzoxazol2ylsulfanyl)methyl)9benzyl891011tetrahydropyrido(4345)thieno(32e)(124)triazolo(15c)pyrimidine
487037627
C1CN(CC2=C1C3=C(S2)N=CN4C3=NC(=N4)CSC5=NC6=CC=CC=C6O5)CC7=CC=CC=C7
InChI=1SC25H20N6OS2c12616(731)123011101720(1330)342422(17)232821(2931(23)152624)1433252718845919(18)3225h1915H1014H2
MFCD03287426
ZINC000020057973
ZINC20057973
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