Vitas-M small molecule compound

6,7-dimethoxy-1-methyl-N-(prop-2-en-1-yl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide

Catalog ID
STK591385
SMILES C=CCNC(=S)N1CCc2c(C1C)cc(c(c2)OC)OC

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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 C16H22N2O2S MW 306.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O2S/c1-5-7-17-16(21)18-8-6-12-9-14(19-3)15(20-4)10-13(12)11(18)2/h5,9-11H,1,6-8H2,2-4H3,(H,17,21)
InChIKey
XUBUPUOMNFZWJW-UHFFFAOYSA-N
Synonyms
883951-16-4
67dimethoxy1methylN(prop2en1yl)34dihydroisoquinoline2(1H)carbothioamide
67dimethoxy1methylNprop2enyl34dihydro1Hisoquinoline2carbothioamide
883951164
CC1C2=CC(=C(C=C2CCN1C(=S)NCC=C)OC)OC
InChI=1SC16H22N2O2Sc1571716(21)188612914(193)15(204)1013(12)11(18)2h5911H168H224H3(H1721)
MFCD07640136
Nallyl67dimethoxy1methyl34dihydroisoquinoline2(1H)carbothioamide
ZINC000005429406
ZINC000005429408

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.