Vitas-M small molecule compound
6-[4-(benzyloxy)phenyl]-4-hydroxy-5-(thiophen-2-ylcarbonyl)-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
Catalog ID
STL090943
SMILES O=C1NC(c2ccc(cc2)OCc2ccccc2)C(C(N1)(O)C(F)(F)F)C(=O)c1cccs1
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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 C23H19F3N2O4S MW 476.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19F3N2O4S/c24-23(25,26)22(31)18(20(29)17-7-4-12-33-17)19(27-21(30)28-22)15-8-10-16(11-9-15)32-13-14-5-2-1-3-6-14/h1-12,18-19,31H,13H2,(H2,27,28,30)InChIKey
DAEGRKBSSXRRQD-UHFFFAOYSA-NSynonyms
4HYDROXY6(4PHENYLMETHOXYPHENYL)5(THIOPHENE2CARBONYL)4(TRIFLUOROMETHYL)13DIAZINAN2ONE
6(4(benzyloxy)phenyl)4hydroxy5(thiophen2ylcarbonyl)4(trifluoromethyl)tetrahydropyrimidin2(1H)one
C1=CC=C(C=C1)COC2=CC=C(C=C2)C3C(C(NC(=O)N3)(C(F)(F)F)O)C(=O)C4=CC=CS4
InChI=1SC23H19F3N2O4Sc2423(2526)22(31)18(20(29)1774123317)19(2721(30)2822)1581016(11915)3213145213614h112181931H13H2(H2272830)
MFCD02653663
ZINC000001155209
ZINC000101513801
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