Vitas-M small molecule compound
4-(4-fluorophenyl)-7,7-dimethyl-1-(5-{[3-(trifluoromethyl)benzyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Catalog ID
STK683718
SMILES Fc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)c1nnc(s1)SCc1cccc(c1)C(F)(F)F
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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 C27H23F4N3O2S2 MW 561.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23F4N3O2S2/c1-26(2)12-20-23(21(35)13-26)19(16-6-8-18(28)9-7-16)11-22(36)34(20)24-32-33-25(38-24)37-14-15-4-3-5-17(10-15)27(29,30)31/h3-10,19H,11-14H2,1-2H3InChIKey
BGWDTDOQWBZHDV-UHFFFAOYSA-NSynonyms
4(4fluorophenyl)77dimethyl1(5((3(trifluoromethyl)benzyl)sulfanyl)134thiadiazol2yl)4678tetrahydroquinoline25(1H3H)dione
4(4fluorophenyl)77dimethyl1(5((3(trifluoromethyl)phenyl)methylsulfanyl)134thiadiazol2yl)3468tetrahydroquinoline25dione
CC1(CC2=C(C(CC(=O)N2C3=NN=C(S3)SCC4=CC(=CC=C4)C(F)(F)F)C5=CC=C(C=C5)F)C(=O)C1)C
InChI=1SC27H23F4N3O2S2c126(2)122023(21(35)1326)19(166818(28)9716)1122(36)34(20)24323325(3824)37141543517(1015)27(2930)31h31019H1114H212H3
MFCD05258608
ZINC000098006272
ZINC000098006273
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