Vitas-M small molecule compound
1-(3-chloro-4-fluorophenyl)-2-{[2-(4-methoxyphenyl)ethyl]sulfanyl}-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole 5,5-dioxide
Catalog ID
STL232934
SMILES COc1ccc(cc1)CCSC1=NC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2
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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 C20H20ClFN2O3S2 MW 454.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClFN2O3S2/c1-27-15-5-2-13(3-6-15)8-9-28-20-23-18-11-29(25,26)12-19(18)24(20)14-4-7-17(22)16(21)10-14/h2-7,10,18-19H,8-9,11-12H2,1H3InChIKey
QBCIEWAPCPXBOV-UHFFFAOYSA-NSynonyms
951929-94-51(3chloro4fluorophenyl)2((2(4methoxyphenyl)ethyl)sulfanyl)3a466atetrahydro1Hthieno(34d)imidazole55dioxide
1(3chloro4fluorophenyl)2((4methoxyphenethyl)thio)3a466atetrahydro1Hthieno(34d)imidazole55dioxide
3(3chloro4fluorophenyl)2(2(4methoxyphenyl)ethylsulfanyl)3a466atetrahydrothieno(34d)imidazole55dioxide
951929945
COC1=CC=C(C=C1)CCSC2=NC3CS(=O)(=O)CC3N2C4=CC(=C(C=C4)F)Cl
InChI=1SC20H20ClFN2O3S2c127155213(3615)89282023181129(2526)1219(18)24(20)144717(22)16(21)1014h27101819H891112H21H3
MFCD09852608
ZINC000013691460
ZINC000013691463
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