Vitas-M small molecule compound
2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-[4-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL060188
SMILES CC(CCn1c(SCC(=O)Nc2ccc(cc2)C(F)(F)F)nc2c(c1=O)cccc2)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 C22H22F3N3O2S MW 449.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22F3N3O2S/c1-14(2)11-12-28-20(30)17-5-3-4-6-18(17)27-21(28)31-13-19(29)26-16-9-7-15(8-10-16)22(23,24)25/h3-10,14H,11-13H2,1-2H3,(H,26,29)InChIKey
AKKHPOLPUVRIJH-UHFFFAOYSA-NSynonyms
2((3(3methylbutyl)4oxo34dihydroquinazolin2yl)sulfanyl)N(4(trifluoromethyl)phenyl)acetamide
2(3(3methylbutyl)4oxoquinazolin2yl)sulfanylN(4(trifluoromethyl)phenyl)acetamide
CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(F)(F)F
InChI=1SC22H22F3N3O2Sc114(2)11122820(30)17534618(17)2721(28)311319(29)26169715(81016)22(2324)25h31014H1113H212H3(H2629)
MFCD18193434
ZINC000057472554
ZINC57472554
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