Vitas-M small molecule compound
N-(2-chloro-4-methylphenyl)-2-{[7-oxo-2-(piperidin-1-yl)-6-(prop-2-en-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Catalog ID
STL124940
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2Cl)C)nc2c(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 C22H24ClN5O2S2 MW 490.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O2S2/c1-3-9-28-20(30)18-19(25-21(32-18)27-10-5-4-6-11-27)26-22(28)31-13-17(29)24-16-8-7-14(2)12-15(16)23/h3,7-8,12H,1,4-6,9-11,13H2,2H3,(H,24,29)InChIKey
BHXFSQHQRKSGDJ-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC=C)SC(=N3)N4CCCCC4)Cl
InChI=1SC22H24ClN5O2S2c1392820(30)1819(2521(3218)27105461127)2622(28)311317(29)24168714(2)1215(16)23h37812H14691113H22H3(H2429)
MFCD20736318
N(2chloro4methylphenyl)2((7oxo2(piperidin1yl)6(prop2en1yl)67dihydro(13)thiazolo(45d)pyrimidin5yl)sulfanyl)acetamide
N(2chloro4methylphenyl)2((7oxo2piperidin1yl6prop2enyl(13)thiazolo(45d)pyrimidin5yl)sulfanyl)acetamide
ZINC000065320151
ZINC65320151
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