Vitas-M small molecule compound
2-{(3S,4R)-4-[(4-ethylphenyl)sulfonyl]-1,1-dioxidotetrahydrothiophen-3-yl}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Catalog ID
STK633920
SMILES COc1cc2CN(CCc2cc1OC)[C@H]1CS(=O)(=O)C[C@@H]1S(=O)(=O)c1ccc(cc1)CC
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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 C23H29NO6S2 MW 479.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO6S2/c1-4-16-5-7-19(8-6-16)32(27,28)23-15-31(25,26)14-20(23)24-10-9-17-11-21(29-2)22(30-3)12-18(17)13-24/h5-8,11-12,20,23H,4,9-10,13-15H2,1-3H3/t20-,23-/m0/s1InChIKey
HDFOCSKQRWDCLZ-REWPJTCUSA-NSynonyms
1212457-47-0(3S4R)3(67dimethoxy34dihydro1Hisoquinolin2yl)4(4ethylphenyl)sulfonylthiolane11dioxide
(3S4R)3(67dimethoxy34dihydroisoquinolin2(1H)yl)4((4ethylphenyl)sulfonyl)tetrahydrothiophene11dioxide
1212457470
2((3S4R)4((4ethylphenyl)sulfonyl)11dioxidotetrahydrothiophen3yl)67dimethoxy1234tetrahydroisoquinoline
CCC1=CC=C(C=C1)S(=O)(=O)C2CS(=O)(=O)CC2N3CCC4=CC(=C(C=C4C3)OC)OC
COc1cc2CN(CCc2cc1OC)(C@H)1CS(=O)(=O)C(C@@H)1S(=O)(=O)c1ccc(cc1)CC
InChI=1SC23H29NO6S2c14165719(8616)32(2728)231531(2526)1420(23)24109171121(292)22(303)1218(17)1324h5811122023H49101315H213H3t2023m0s1
MFCD18246574
ZINC000019820972
ZINC19820972
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