Vitas-M small molecule compound
6-benzyl-10,10-dimethyl-2-phenyl-6,8,10,11-tetrahydro-5H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
Catalog ID
STK936473
SMILES O=c1n(Cc2ccccc2)c2sc3c(c2c2n1nc(n2)c1ccccc1)CC(OC3)(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 C25H22N4O2S MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O2S/c1-25(2)13-18-19(15-31-25)32-23-20(18)22-26-21(17-11-7-4-8-12-17)27-29(22)24(30)28(23)14-16-9-5-3-6-10-16/h3-12H,13-15H2,1-2H3InChIKey
CRQDIJIKYHXMBH-UHFFFAOYSA-NSynonyms
929845-11-46benzyl1010dimethyl2phenyl681011tetrahydro5Hpyrano(4345)thieno(32e)(124)triazolo(15c)pyrimidin5one
929845114
CC1(CC2=C(CO1)SC3=C2C4=NC(=NN4C(=O)N3CC5=CC=CC=C5)C6=CC=CC=C6)C
InChI=1SC25H22N4O2Sc125(2)131819(153125)322320(18)222621(17117481217)2729(22)24(30)28(23)141695361016h312H1315H212H3
MFCD09846660
ZINC000009576247
ZINC9576247
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