Vitas-M small molecule compound

(1Z)-1-[(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)methylidene]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Catalog ID
STK589627
SMILES COc1cc2CCN/C(=C\S(=O)(=O)c3ccc4c(c3)OCCO4)/c2cc1OC

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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 C20H21NO6S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO6S/c1-24-18-9-13-5-6-21-16(15(13)11-19(18)25-2)12-28(22,23)14-3-4-17-20(10-14)27-8-7-26-17/h3-4,9-12,21H,5-8H2,1-2H3/b16-12-
InChIKey
QKNGUAQJKYUOKH-VBKFSLOCSA-N
Synonyms
902009-66-9
(1Z)1((23dihydro14benzodioxin6ylsulfonyl)methylidene)67dimethoxy1234tetrahydroisoquinoline
(1Z)1(23DIHYDRO14BENZODIOXIN6YLSULFONYLMETHYLIDENE)67DIMETHOXY34DIHYDRO2HISOQUINOLINE
(Z)1(((23dihydrobenzo(b)(14)dioxin6yl)sulfonyl)methylene)67dimethoxy1234tetrahydroisoquinoline
902009669
COC1=C(C=C2C(=C1)CCNC2=CS(=O)(=O)C3=CC4=C(C=C3)OCCO4)OC
COc1cc2CCNC(=CS(=O)(=O)c3ccc4c(c3)OCCO4)c2cc1OC
InChI=1SC20H21NO6Sc12418913562116(15(13)1119(18)252)1228(2223)14341720(1014)27872617h3491221H58H212H3b1612
MFCD06781600
ZINC000101343244
ZINC101343244

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Available files

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