Vitas-M small molecule compound
2-[(4-{[(4-methylphenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK089989
SMILES O=C(Nc1cccc(c1)C(F)(F)F)CSc1nc(CSc2ccc(cc2)C)cc(=O)[nH]1
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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 C21H18F3N3O2S2 MW 465.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3N3O2S2/c1-13-5-7-17(8-6-13)30-11-16-10-18(28)27-20(26-16)31-12-19(29)25-15-4-2-3-14(9-15)21(22,23)24/h2-10H,11-12H2,1H3,(H,25,29)(H,26,27,28)InChIKey
VPNCGLXXPNMPOR-UHFFFAOYSA-NSynonyms
2((4(((4METHYLPHENYL)SULFANYL)METHYL)6OXO16DIHYDROPYRIMIDIN2YL)SULFANYL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((6((4METHYLPHENYL)SULFANYLMETHYL)4OXO1HPYRIMIDIN2YL)SULFANYL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
CC1=CC=C(C=C1)SCC2=CC(=O)N=C(N2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC21H18F3N3O2S2c1135717(8613)3011161018(28)2720(2616)311219(29)251542314(915)21(2223)24h210H1112H21H3(H2529)(H262728)
MFCD01953945
O=C(Nc1cccc(c1)C(F)(F)F)CSc1nc(CSc2ccc(cc2)C)cc(=O)(nH)1
STK089989
ZINC000001218121
ZINC1218121
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