Vitas-M small molecule compound
4-ethyl-1-{[4-(propan-2-yloxy)benzyl]sulfanyl}-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK841647
SMILES CCn1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCc1ccc(cc1)OC(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 C23H26N4O2S2 MW 454.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O2S2/c1-4-26-20(28)19-17-7-5-6-8-18(17)31-21(19)27-22(26)24-25-23(27)30-13-15-9-11-16(12-10-15)29-14(2)3/h9-12,14H,4-8,13H2,1-3H3InChIKey
MFAULOHSBRWWNP-UHFFFAOYSA-NSynonyms
488804-58-6488804586
4ethyl1((4(propan2yloxy)benzyl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4ethyl1((4isopropoxybenzyl)thio)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CCN1C(=O)C2=C(N3C1=NN=C3SCC4=CC=C(C=C4)OC(C)C)SC5=C2CCCC5
InChI=1SC23H26N4O2S2c142620(28)1917756818(17)3121(19)2722(26)242523(27)30131591116(121015)2914(2)3h91214H4813H213H3
MFCD03293293
ZINC000001130658
ZINC01130658
ZINC1130658
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