Vitas-M small molecule compound
methyl 4-chloro-2-[({[2-(morpholin-4-yl)[1,3]thiazolo[4,5-d]pyrimidin-7-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL080245
SMILES COC(=O)c1ccc(cc1NC(=O)CSc1ncnc2c1sc(n2)N1CCOCC1)Cl
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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 C19H18ClN5O4S2 MW 479.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN5O4S2/c1-28-18(27)12-3-2-11(20)8-13(12)23-14(26)9-30-17-15-16(21-10-22-17)24-19(31-15)25-4-6-29-7-5-25/h2-3,8,10H,4-7,9H2,1H3,(H,23,26)InChIKey
GGKGEMIGTXONSI-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC=NC3=C2SC(=N3)N4CCOCC4
InChI=1SC19H18ClN5O4S2c12818(27)123211(20)813(12)2314(26)930171516(21102217)2419(3115)2546297525h23810H479H21H3(H2326)
methyl4chloro2((((2(morpholin4yl)(13)thiazolo(45d)pyrimidin7yl)sulfanyl)acetyl)amino)benzoate
methyl4chloro2((2((2morpholin4yl(13)thiazolo(45d)pyrimidin7yl)sulfanyl)acetyl)amino)benzoate
MFCD18201011
ZINC000067219728
ZINC67219728
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