Vitas-M small molecule compound
4-(4-methoxyphenyl)-1-(methylsulfanyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK538692
SMILES CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CC(OC3)C(C)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 C21H22N4O3S2 MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S2/c1-11(2)15-9-14-16(10-28-15)30-19-17(14)18(26)24(12-5-7-13(27-3)8-6-12)20-22-23-21(29-4)25(19)20/h5-8,11,15H,9-10H2,1-4H3InChIKey
LHLFCISWNXHFBN-UHFFFAOYSA-NSynonyms
369401-42-3369401423
4(4methoxyphenyl)1(methylsulfanyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
7isopropyl4(4methoxyphenyl)1(methylthio)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SC)C5=CC=C(C=C5)OC
InChI=1SC21H22N4O3S2c111(2)1591416(102815)301917(14)18(26)24(125713(273)8612)20222321(294)25(19)20h581115H910H214H3
MFCD03010774
ZINC000001241867
ZINC000001241868
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