Vitas-M small molecule compound
ethyl {[5-oxo-4-phenyl-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
STK830901
SMILES CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)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 C23H24N4O4S2 MW 484.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O4S2/c1-4-30-18(28)12-32-23-25-24-22-26(14-8-6-5-7-9-14)20(29)19-15-10-16(13(2)3)31-11-17(15)33-21(19)27(22)23/h5-9,13,16H,4,10-12H2,1-3H3InChIKey
BUUIMIIUAGYYOK-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C(=O)N2C5=CC=CC=C5
ethyl((5oxo4phenyl7(propan2yl)4569tetrahydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetate
ethyl2((7isopropyl5oxo4phenyl5679tetrahydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)acetate
InChI=1SC23H24N4O4S2c143018(28)12322325242226(148657914)20(29)19151016(13(2)3)311117(15)3321(19)27(22)23h591316H41012H213H3
MFCD02993902
ZINC000002301467
ZINC000002301468
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