Vitas-M small molecule compound
1-[(4-methoxybenzyl)sulfanyl]-4-methyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK720521
SMILES COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2C)CCCC3
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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/c1-23-17(25)16-14-5-3-4-6-15(14)28-18(16)24-19(23)21-22-20(24)27-11-12-7-9-13(26-2)10-8-12/h7-10H,3-6,11H2,1-2H3InChIKey
FZOCIKRGPUPCBK-UHFFFAOYSA-NSynonyms
497246-55-61((4methoxybenzyl)sulfanyl)4methyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((4methoxybenzyl)thio)4methyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
497246556
CN1C(=O)C2=C(N3C1=NN=C3SCC4=CC=C(C=C4)OC)SC5=C2CCCC5
InChI=1SC20H20N4O2S2c12317(25)1614534615(14)2818(16)2419(23)212220(24)2711127913(262)10812h710H3611H212H3
MFCD03298071
ZINC000001245303
ZINC01245303
ZINC1245303
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