Vitas-M small molecule compound
1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-7,7-dimethyl-4-(thiophen-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Catalog ID
STK775238
SMILES O=C1CC(C)(C)CC2=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 C24H22ClN3O2S3 MW 516.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClN3O2S3/c1-24(2)10-18-21(19(29)11-24)16(14-7-8-31-12-14)9-20(30)28(18)22-26-27-23(33-22)32-13-15-5-3-4-6-17(15)25/h3-8,12,16H,9-11,13H2,1-2H3InChIKey
CPAVQABVMIQGDU-UHFFFAOYSA-NSynonyms
1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)77dimethyl4(thiophen3yl)4678tetrahydroquinoline25(1H3H)dione
1(5((2chlorophenyl)methylsulfanyl)134thiadiazol2yl)77dimethyl4thiophen3yl3468tetrahydroquinoline25dione
CC1(CC2=C(C(CC(=O)N2C3=NN=C(S3)SCC4=CC=CC=C4Cl)C5=CSC=C5)C(=O)C1)C
InChI=1SC24H22ClN3O2S3c124(2)101821(19(29)1124)16(1478311214)920(30)28(18)22262723(3322)321315534617(15)25h381216H91113H212H3
MFCD05256952
ZINC000001421894
ZINC000001421895
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