Vitas-M small molecule compound
ethyl {[4-(3-methylphenyl)-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
STK540640
SMILES CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)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/c1-5-31-19(29)12-33-24-26-25-23-27(15-8-6-7-14(4)9-15)21(30)20-16-10-17(13(2)3)32-11-18(16)34-22(20)28(23)24/h6-9,13,17H,5,10-12H2,1-4H3InChIKey
UOMKVPZFYSWHHY-UHFFFAOYSA-NSynonyms
370573-05-0370573050
CCOC(=O)CSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C(=O)N2C5=CC=CC(=C5)C
ethyl((4(3methylphenyl)5oxo7(propan2yl)4569tetrahydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetate
ethyl2((7isopropyl5oxo4(mtolyl)5679tetrahydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)acetate
InChI=1SC24H26N4O4S2c153119(29)12332426252327(1586714(4)915)21(30)20161017(13(2)3)321118(16)3422(20)28(23)24h691317H51012H214H3
MFCD03011007
ZINC000001260410
ZINC000001260411
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