Vitas-M small molecule compound
1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Catalog ID
STK774471
SMILES O=C1CC(C2=C(N1c1nnc(s1)SCc1ccccc1Cl)CCCC2=O)c1ccccc1C
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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 C25H22ClN3O2S2 MW 496.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O2S2/c1-15-7-2-4-9-17(15)18-13-22(31)29(20-11-6-12-21(30)23(18)20)24-27-28-25(33-24)32-14-16-8-3-5-10-19(16)26/h2-5,7-10,18H,6,11-14H2,1H3InChIKey
IGMCCZALCNFLJU-UHFFFAOYSA-NSynonyms
1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)4(2methylphenyl)4678tetrahydroquinoline25(1H3H)dione
1(5((2chlorophenyl)methylsulfanyl)134thiadiazol2yl)4(2methylphenyl)4678tetrahydro3Hquinoline25dione
CC1=CC=CC=C1C2CC(=O)N(C3=C2C(=O)CCC3)C4=NN=C(S4)SCC5=CC=CC=C5Cl
InChI=1SC25H22ClN3O2S2c115724917(15)181322(31)29(201161221(30)23(18)20)24272825(3324)3214168351019(16)26h2571018H61114H21H3
MFCD04060849
ZINC000001445836
ZINC000001445837
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