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-(trifluoromethoxy)phenyl]acetamide

Catalog ID
STK681233
SMILES O=C(Nc1ccc(cc1)OC(F)(F)F)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 C24H19F6N5O4S MW 587.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19F6N5O4S/c1-33-19-18(20(37)34(2)22(33)38)35(11-13-4-3-5-14(10-13)23(25,26)27)21(32-19)40-12-17(36)31-15-6-8-16(9-7-15)39-24(28,29)30/h3-10H,11-12H2,1-2H3,(H,31,36)
InChIKey
QXGJFCFIOYUKHJ-UHFFFAOYSA-N
Synonyms
2((13dimethyl26dioxo7(3(trifluoromethyl)benzyl)2367tetrahydro1Hpurin8yl)sulfanyl)N(4(trifluoromethoxy)phenyl)acetamide
2(13DIMETHYL26DIOXO7((3(TRIFLUOROMETHYL)PHENYL)METHYL)PURIN8YL)SULFANYLN(4(TRIFLUOROMETHOXY)PHENYL)ACETAMIDE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)OC(F)(F)F)CC4=CC(=CC=C4)C(F)(F)F
Registry IDs
MFCD03768733
ZINC000001076746
ZINC1076746

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Available files

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