Vitas-M small molecule compound
2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-9-(propan-2-yl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK556299
SMILES CC(N1CCc2c(C1)sc1c2c2nc(nn2cn1)CSc1nc2c(o1)cccc2)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 C21H20N6OS2 MW 436.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6OS2/c1-12(2)26-8-7-13-16(9-26)30-20-18(13)19-24-17(25-27(19)11-22-20)10-29-21-23-14-5-3-4-6-15(14)28-21/h3-6,11-12H,7-10H2,1-2H3InChIKey
OICOWFDJQOCDTC-UHFFFAOYSA-NSynonyms
843633-23-82(((9isopropyl891011tetrahydropyrido(4345)thieno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)thio)benzo(d)oxazole
2((13benzoxazol2ylsulfanyl)methyl)9(propan2yl)891011tetrahydropyrido(4345)thieno(32e)(124)triazolo(15c)pyrimidine
843633238
CC(C)N1CCC2=C(C1)SC3=C2C4=NC(=NN4C=N3)CSC5=NC6=CC=CC=C6O5
InChI=1SC21H20N6OS2c112(2)26871316(926)302018(13)192417(2527(19)112220)1029212314534615(14)2821h361112H710H212H3
MFCD04017031
ZINC000020290682
ZINC20290682
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