Vitas-M small molecule compound
ethyl 4-({[2-(3-methylpiperidin-1-yl)-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetyl}amino)benzoate
Catalog ID
STL103217
SMILES CCOC(=O)c1ccc(cc1)NC(=O)Cn1cnc2c(c1=O)sc(n2)N1CCCC(C1)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 C22H25N5O4S MW 455.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4S/c1-3-31-21(30)15-6-8-16(9-7-15)24-17(28)12-27-13-23-19-18(20(27)29)32-22(25-19)26-10-4-5-14(2)11-26/h6-9,13-14H,3-5,10-12H2,1-2H3,(H,24,28)InChIKey
UTTTTYPUXBRVQU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)SC(=N3)N4CCCC(C4)C
ethyl4(((2(3methylpiperidin1yl)7oxo(13)thiazolo(45d)pyrimidin6(7H)yl)acetyl)amino)benzoate
ethyl4((2(2(3methylpiperidin1yl)7oxo(13)thiazolo(45d)pyrimidin6yl)acetyl)amino)benzoate
InChI=1SC22H25N5O4Sc133121(30)156816(9715)2417(28)122713231918(20(27)29)3222(2519)26104514(2)1126h691314H351012H212H3(H2428)
MFCD20734832
ZINC000067226076
ZINC000067226078
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