Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-2-{2-[(4-methylbenzyl)sulfanyl]-5-oxo-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}acetamide
Catalog ID
STL576848
SMILES O=C(Nc1cccc(c1C)Cl)CC1Cn2nc(nc2NC1=O)SCc1ccc(cc1)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 C22H22ClN5O2S MW 455.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O2S/c1-13-6-8-15(9-7-13)12-31-22-26-21-25-20(30)16(11-28(21)27-22)10-19(29)24-18-5-3-4-17(23)14(18)2/h3-9,16H,10-12H2,1-2H3,(H,24,29)(H,25,26,27,30)InChIKey
UFXJGRISAZAQAY-UHFFFAOYSA-NSynonyms
145916623
InChI=1SC22H22ClN5O2Sc1136815(9713)12312226212520(30)16(1128(21)2722)1019(29)241853417(23)14(18)2h3916H1012H212H3(H2429)(H25262730)
MFCD32650455
N(3chloro2methylphenyl)2(2((4methylbenzyl)sulfanyl)5oxo4567tetrahydro(124)triazolo(15a)pyrimidin6yl)acetamide
N(3chloro2methylphenyl)2(2((4methylphenyl)methylsulfanyl)5oxo67dihydro4H(124)triazolo(15a)pyrimidin6yl)acetamide
ZINC001848442466
ZINC001848442467
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