Vitas-M small molecule compound
2-({1,3-dimethyl-2,6-dioxo-7-[3-(trifluoromethyl)benzyl]-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)-N-(4-ethylphenyl)acetamide
Catalog ID
STK667352
SMILES CCc1ccc(cc1)NC(=O)CSc1nc2c(n1Cc1cccc(c1)C(F)(F)F)c(=O)n(c(=O)n2C)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 C25H24F3N5O3S MW 531.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24F3N5O3S/c1-4-15-8-10-18(11-9-15)29-19(34)14-37-23-30-21-20(22(35)32(3)24(36)31(21)2)33(23)13-16-6-5-7-17(12-16)25(26,27)28/h5-12H,4,13-14H2,1-3H3,(H,29,34)InChIKey
ASEPWYLKHNUTRZ-UHFFFAOYSA-NSynonyms
2((13dimethyl26dioxo7(3(trifluoromethyl)benzyl)2367tetrahydro1Hpurin8yl)sulfanyl)N(4ethylphenyl)acetamide
2(13DIMETHYL26DIOXO7((3(TRIFLUOROMETHYL)PHENYL)METHYL)PURIN8YL)SULFANYLN(4ETHYLPHENYL)ACETAMIDE
CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2CC4=CC(=CC=C4)C(F)(F)F)C(=O)N(C(=O)N3C)C
InChI=1SC25H24F3N5O3Sc141581018(11915)2919(34)143723302120(22(35)32(3)24(36)31(21)2)33(23)131665717(1216)25(2627)28h512H41314H213H3(H2934)
MFCD05858221
ZINC000001429020
ZINC1429020
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