Vitas-M small molecule compound
ethyl {[4-benzyl-5-oxo-7-(propan-2-yl)-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetate
Catalog ID
STK539514
SMILES CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(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 C24H26N4O4S2 MW 498.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O4S2/c1-4-31-19(29)13-33-24-26-25-23-27(11-15-8-6-5-7-9-15)21(30)20-16-10-17(14(2)3)32-12-18(16)34-22(20)28(23)24/h5-9,14,17H,4,10-13H2,1-3H3InChIKey
FLMXILQEYWZKLE-UHFFFAOYSA-NSynonyms
384369-38-4384369384
CCOC(=O)CSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C(=O)N2CC5=CC=CC=C5
ethyl((4benzyl5oxo7(propan2yl)4569tetrahydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetate
ethyl2((4benzyl7isopropyl5oxo5679tetrahydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)acetate
InChI=1SC24H26N4O4S2c143119(29)13332426252327(11158657915)21(30)20161017(14(2)3)321218(16)3422(20)28(23)24h591417H41013H213H3
MFCD03284788
ZINC000001258128
ZINC000001258131
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