Vitas-M small molecule compound
methyl 3-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)-4-phenylthiophene-2-carboxylate
Catalog ID
STL095554
SMILES COC(=O)c1scc(c1S(=O)(=O)N1CCc2c(C1)cccc2)c1ccccc1
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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 C21H19NO4S2 MW 413.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO4S2/c1-26-21(23)19-20(18(14-27-19)16-8-3-2-4-9-16)28(24,25)22-12-11-15-7-5-6-10-17(15)13-22/h2-10,14H,11-13H2,1H3InChIKey
PHAYLWHNWWURBZ-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C(=CS1)C2=CC=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3
InChI=1SC21H19NO4S2c12621(23)1920(18(142719)168324916)28(2425)221211157561017(15)1322h21014H1113H21H3
methyl3(34dihydro1Hisoquinolin2ylsulfonyl)4phenylthiophene2carboxylate
methyl3(34dihydroisoquinolin2(1H)ylsulfonyl)4phenylthiophene2carboxylate
MFCD08140840
ZINC000009645819
ZINC9645819
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