Vitas-M small molecule compound
2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethanone
Catalog ID
STK011276
SMILES CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)CSc1nc(O)cc(n1)CSc1ccc(cc1)Cl)(C)C
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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 C27H24ClN3O3S5 MW 634.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClN3O3S5/c1-4-34-17-7-10-20-19(12-17)23-24(38-39-25(23)35)27(2,3)31(20)22(33)14-37-26-29-16(11-21(32)30-26)13-36-18-8-5-15(28)6-9-18/h5-12H,4,13-14H2,1-3H3,(H,29,30,32)InChIKey
WNFHLELYIVXBPG-UHFFFAOYSA-NSynonyms
2((4(((4CHLOROPHENYL)SULFANYL)METHYL)6HYDROXYPYRIMIDIN2YL)SULFANYL)1(8ETHOXY44DIMETHYL1THIOXO14DIHYDRO5H(12)DITHIOLO(34C)QUINOLIN5YL)ETHANONE
6((4CHLOROPHENYL)SULFANYLMETHYL)2(2(8ETHOXY44DIMETHYL1SULFANYLIDENEDITHIOLO(34C)QUINOLIN5YL)2OXOETHYL)SULFANYL1HPYRIMIDIN4ONE
CCOC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)C(=O)CSC4=NC(=O)C=C(N4)CSC5=CC=C(C=C5)Cl
CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)CSc1nc(O)cc(n1)CSc1ccc(cc1)Cl)(C)C
InChI=1SC27H24ClN3O3S5c1434177102019(1217)2324(383925(23)35)27(23)31(20)22(33)1437262916(1121(32)3026)1336188515(28)6918h512H41314H213H3(H293032)
MFCD02127897
STK011276
ZINC000033355230
ZINC33355230
Check stock
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Check stock on Vitas-MAvailable files
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