Vitas-M small molecule compound
methyl 2-({[7-oxo-2-(piperidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetyl}amino)benzoate
Catalog ID
STL110723
SMILES COC(=O)c1ccccc1NC(=O)Cn1cnc2c(c1=O)sc(n2)N1CCCCC1
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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 C20H21N5O4S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4S/c1-29-19(28)13-7-3-4-8-14(13)22-15(26)11-25-12-21-17-16(18(25)27)30-20(23-17)24-9-5-2-6-10-24/h3-4,7-8,12H,2,5-6,9-11H2,1H3,(H,22,26)InChIKey
DOFMJCWCFFRFCT-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1NC(=O)CN2C=NC3=C(C2=O)SC(=N3)N4CCCCC4
InChI=1SC20H21N5O4Sc12919(28)13734814(13)2215(26)112512211716(18(25)27)3020(2317)2495261024h347812H256911H21H3(H2226)
methyl2(((7oxo2(piperidin1yl)(13)thiazolo(45d)pyrimidin6(7H)yl)acetyl)amino)benzoate
methyl2((2(7oxo2piperidin1yl(13)thiazolo(45d)pyrimidin6yl)acetyl)amino)benzoate
MFCD20745571
ZINC000067317003
ZINC67317003
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