Vitas-M small molecule compound
4,7,7-trimethyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-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
STL005179
SMILES O=C(c1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2C)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 C21H20N4O3S2 MW 440.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S2/c1-21(2)9-13-15(10-28-21)30-18-16(13)17(27)24(3)19-22-23-20(25(18)19)29-11-14(26)12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3InChIKey
WUXJYESDBPUYJJ-UHFFFAOYSA-NSynonyms
303965-89-1303965891
477trimethyl1((2oxo2phenylethyl)sulfanyl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
477trimethyl1((2oxo2phenylethyl)thio)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)C5=CC=CC=C5)C)C
InChI=1SC21H20N4O3S2c121(2)91315(102821)301816(13)17(27)24(3)19222320(25(18)19)291114(26)127546812h48H911H213H3
MFCD01558383
ZINC000002230312
ZINC02230312
ZINC2230312
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