Vitas-M small molecule compound
(3S,4R)-N-[2-(1H-indol-3-yl)ethyl]-4-[(4-methoxy-3-methylphenyl)sulfonyl]tetrahydrothiophen-3-amine 1,1-dioxide
Catalog ID
STK646307
SMILES COc1ccc(cc1C)S(=O)(=O)[C@H]1CS(=O)(=O)C[C@@H]1NCCc1c[nH]c2c1cccc2
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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 C22H26N2O5S2 MW 462.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O5S2/c1-15-11-17(7-8-21(15)29-2)31(27,28)22-14-30(25,26)13-20(22)23-10-9-16-12-24-19-6-4-3-5-18(16)19/h3-8,11-12,20,22-24H,9-10,13-14H2,1-2H3/t20-,22-/m0/s1InChIKey
PPCHMKCHKYFAOI-UNMCSNQZSA-NSynonyms
1175751-94-6(3S4R)3((2(1Hindol3yl)ethyl)amino)4((4methoxy3methylphenyl)sulfonyl)tetrahydrothiophene11dioxide
(3S4R)N(2(1Hindol3yl)ethyl)4((4methoxy3methylphenyl)sulfonyl)tetrahydrothiophen3amine11dioxide
(3S4R)N(2(1Hindol3yl)ethyl)4(4methoxy3methylphenyl)sulfonyl11dioxothiolan3amine
1175751946
CC1=C(C=CC(=C1)S(=O)(=O)C2CS(=O)(=O)CC2NCCC3=CNC4=CC=CC=C43)OC
COc1ccc(cc1C)S(=O)(=O)(C@H)1CS(=O)(=O)C(C@@H)1NCCc1c(nH)c2c1cccc2
InChI=1SC22H26N2O5S2c1151117(7821(15)292)31(2728)221430(2526)1320(22)2310916122419643518(16)19h381112202224H9101314H212H3t2022m0s1
MFCD18246777
ZINC000019821014
ZINC19821014
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