Vitas-M small molecule compound
1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(thiophen-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Catalog ID
STK776157
SMILES O=C1CCCC2=C1C(CC(=O)N2c1nnc(s1)SCc1ccccc1Cl)c1ccsc1
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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 C22H18ClN3O2S3 MW 488.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O2S3/c23-16-5-2-1-4-14(16)12-30-22-25-24-21(31-22)26-17-6-3-7-18(27)20(17)15(10-19(26)28)13-8-9-29-11-13/h1-2,4-5,8-9,11,15H,3,6-7,10,12H2InChIKey
CRXLDQJNWWWIMH-UHFFFAOYSA-NSynonyms
1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)4(thiophen3yl)4678tetrahydroquinoline25(1H3H)dione
1(5((2chlorophenyl)methylsulfanyl)134thiadiazol2yl)4thiophen3yl4678tetrahydro3Hquinoline25dione
C1CC2=C(C(CC(=O)N2C3=NN=C(S3)SCC4=CC=CC=C4Cl)C5=CSC=C5)C(=O)C1
InChI=1SC22H18ClN3O2S3c2316521414(16)123022252421(3122)261763718(27)20(17)15(1019(26)28)1389291113h1245891115H3671012H2
MFCD05258607
ZINC000001423058
ZINC000001423059
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