Vitas-M small molecule compound
ethyl 4-{[(5-oxo-6,7,8,9-tetrahydro-5H-[1]benzothieno[2,3-d][1,3]thiazolo[3,2-a]pyrimidin-2-yl)methyl]amino}benzoate
Catalog ID
STL079476
SMILES CCOC(=O)c1ccc(cc1)NCc1cn2c(s1)nc1c(c2=O)c2CCCCc2s1
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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 C22H21N3O3S2 MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S2/c1-2-28-21(27)13-7-9-14(10-8-13)23-11-15-12-25-20(26)18-16-5-3-4-6-17(16)30-19(18)24-22(25)29-15/h7-10,12,23H,2-6,11H2,1H3InChIKey
MNFYFRIEYBOBDJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NCC2=CN3C(=O)C4=C(N=C3S2)SC5=C4CCCC5
ethyl4(((5oxo6789tetrahydro5H(1)benzothieno(23d)(13)thiazolo(32a)pyrimidin2yl)methyl)amino)benzoate
InChI=1SC22H21N3O3S2c122821(27)137914(10813)231115122520(26)1816534617(16)3019(18)2422(25)2915h7101223H2611H21H3
MFCD04215371
ZINC000002843165
ZINC02843165
ZINC2843165
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