Vitas-M small molecule compound
4-benzyl-7-(propan-2-yl)-1-thioxo-2,4,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Catalog ID
STK846087
SMILES CC(C1OCc2c(C1)c1c(=O)n(Cc3ccccc3)c3n(c1s2)c(=S)[nH]n3)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 C20H20N4O2S2 MW 412.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S2/c1-11(2)14-8-13-15(10-26-14)28-18-16(13)17(25)23(9-12-6-4-3-5-7-12)19-21-22-20(27)24(18)19/h3-7,11,14H,8-10H2,1-2H3,(H,22,27)InChIKey
BYPIQBYLJZTMDQ-UHFFFAOYSA-NSynonyms
370869-69-5370869695
4benzyl7(propan2yl)1thioxo2469tetrahydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(1H)one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C4=NNC(=S)N34)CC5=CC=CC=C5
CC(C1OCc2c(C1)c1c(=O)n(Cc3ccccc3)c3n(c1s2)c(=S)(nH)n3)C
InChI=1SC20H20N4O2S2c111(2)1481315(102614)281816(13)17(25)23(9126435712)19212220(27)24(18)19h371114H810H212H3(H2227)
MFCD03818419
ZINC000005610555
ZINC000005611222
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