Vitas-M small molecule compound
2-{(3S,4R)-4-[(4-ethylphenyl)sulfonyl]-1,1-dioxidotetrahydrothiophen-3-yl}-1,2,3,4-tetrahydroisoquinoline
Catalog ID
STK637023
SMILES CCc1ccc(cc1)S(=O)(=O)[C@H]1CS(=O)(=O)C[C@@H]1N1CCc2c(C1)cccc2
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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 C21H25NO4S2 MW 419.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO4S2/c1-2-16-7-9-19(10-8-16)28(25,26)21-15-27(23,24)14-20(21)22-12-11-17-5-3-4-6-18(17)13-22/h3-10,20-21H,2,11-15H2,1H3/t20-,21-/m0/s1InChIKey
JYSWZUGHPNGASC-SFTDATJTSA-NSynonyms
1175794-20-3(3S4R)3(34dihydro1Hisoquinolin2yl)4(4ethylphenyl)sulfonylthiolane11dioxide
(3S4R)3(34dihydroisoquinolin2(1H)yl)4((4ethylphenyl)sulfonyl)tetrahydrothiophene11dioxide
1175794203
2((3S4R)4((4ethylphenyl)sulfonyl)11dioxidotetrahydrothiophen3yl)1234tetrahydroisoquinoline
CCC1=CC=C(C=C1)S(=O)(=O)C2CS(=O)(=O)CC2N3CCC4=CC=CC=C4C3
CCc1ccc(cc1)S(=O)(=O)(C@H)1CS(=O)(=O)C(C@@H)1N1CCc2c(C1)cccc2
InChI=1SC21H25NO4S2c12167919(10816)28(2526)211527(2324)1420(21)22121117534618(17)1322h3102021H21115H21H3t2021m0s1
MFCD18246618
ZINC000019820952
ZINC19820952
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