Vitas-M small molecule compound
(3S,4R)-N-(1,3-benzodioxol-5-ylmethyl)-4-[(4-methoxy-3-methylphenyl)sulfonyl]tetrahydrothiophen-3-amine 1,1-dioxide
Catalog ID
STK634805
SMILES COc1ccc(cc1C)S(=O)(=O)[C@H]1CS(=O)(=O)C[C@@H]1NCc1ccc2c(c1)OCO2
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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 C20H23NO7S2 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO7S2/c1-13-7-15(4-6-17(13)26-2)30(24,25)20-11-29(22,23)10-16(20)21-9-14-3-5-18-19(8-14)28-12-27-18/h3-8,16,20-21H,9-12H2,1-2H3/t16-,20-/m0/s1InChIKey
SQKYLKPCFSFPJH-JXFKEZNVSA-NSynonyms
1212358-25-2(3S4R)3((benzo(d)(13)dioxol5ylmethyl)amino)4((4methoxy3methylphenyl)sulfonyl)tetrahydrothiophene11dioxide
(3S4R)N(13benzodioxol5ylmethyl)4((4methoxy3methylphenyl)sulfonyl)tetrahydrothiophen3amine11dioxide
(3S4R)N(13benzodioxol5ylmethyl)4(4methoxy3methylphenyl)sulfonyl11dioxothiolan3amine
1212358252
CC1=C(C=CC(=C1)S(=O)(=O)C2CS(=O)(=O)CC2NCC3=CC4=C(C=C3)OCO4)OC
COc1ccc(cc1C)S(=O)(=O)(C@H)1CS(=O)(=O)C(C@@H)1NCc1ccc2c(c1)OCO2
InChI=1SC20H23NO7S2c113715(4617(13)262)30(2425)201129(2223)1016(20)21914351819(814)28122718h38162021H912H212H3t1620m0s1
MFCD18246594
ZINC000054093189
ZINC54093189
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