Vitas-M small molecule compound

3,4-dihydroisoquinolin-2(1H)-yl{3-[(1,1-dioxidotetrahydrothiophen-3-yl)sulfonyl]phenyl}methanone

Catalog ID
STK653392
SMILES O=C(N1CCc2c(C1)cccc2)c1cccc(c1)S(=O)(=O)C1CCS(=O)(=O)C1

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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 C20H21NO5S2 MW 419.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5S2/c22-20(21-10-8-15-4-1-2-5-17(15)13-21)16-6-3-7-18(12-16)28(25,26)19-9-11-27(23,24)14-19/h1-7,12,19H,8-11,13-14H2
InChIKey
KSNHNNANQUPVQI-UHFFFAOYSA-N
Synonyms
1011693-88-1
(34dihydroisoquinolin2(1H)yl)(3((11dioxidotetrahydrothiophen3yl)sulfonyl)phenyl)methanone
1011693881
34dihydro1Hisoquinolin2yl(3(11dioxothiolan3yl)sulfonylphenyl)methanone
34dihydroisoquinolin2(1H)yl(3((11dioxidotetrahydrothiophen3yl)sulfonyl)phenyl)methanone
C1CS(=O)(=O)CC1S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3
InChI=1SC20H21NO5S2c2220(2110815412517(15)1321)1663718(1216)28(2526)1991127(2324)1419h171219H8111314H2
MFCD10077832
ZINC000012030272
ZINC000012030274

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Available files

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