Vitas-M small molecule compound

4-(thiophen-2-yl)-1-(5-{[3-(trifluoromethyl)benzyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione

Catalog ID
STK682862
SMILES O=C1CCCC2=C1C(CC(=O)N2c1nnc(s1)SCc1cccc(c1)C(F)(F)F)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 C23H18F3N3O2S3 MW 521.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18F3N3O2S3/c24-23(25,26)14-5-1-4-13(10-14)12-33-22-28-27-21(34-22)29-16-6-2-7-17(30)20(16)15(11-19(29)31)18-8-3-9-32-18/h1,3-5,8-10,15H,2,6-7,11-12H2
InChIKey
SMUXKGLVJUMPME-UHFFFAOYSA-N
Synonyms

4(thiophen2yl)1(5((3(trifluoromethyl)benzyl)sulfanyl)134thiadiazol2yl)4678tetrahydroquinoline25(1H3H)dione
4thiophen2yl1(5((3(trifluoromethyl)phenyl)methylsulfanyl)134thiadiazol2yl)4678tetrahydro3Hquinoline25dione
C1CC2=C(C(CC(=O)N2C3=NN=C(S3)SCC4=CC(=CC=C4)C(F)(F)F)C5=CC=CS5)C(=O)C1
InChI=1SC23H18F3N3O2S3c2423(2526)1451413(1014)123322282721(3422)291662717(30)20(16)15(1119(29)31)188393218h13581015H2671112H2
MFCD04061029
ZINC000001445962
ZINC000001445963

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Available files

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