Vitas-M small molecule compound

1-(1,3-benzodioxol-5-yl)-3-(4,6-dimethylpyridin-2-yl)thiourea

Catalog ID
STK456953
SMILES S=C(Nc1cc(C)cc(n1)C)Nc1ccc2c(c1)OCO2

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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 C15H15N3O2S MW 301.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O2S/c1-9-5-10(2)16-14(6-9)18-15(21)17-11-3-4-12-13(7-11)20-8-19-12/h3-7H,8H2,1-2H3,(H2,16,17,18,21)
InChIKey
LLJCKRQCKSCWFV-UHFFFAOYSA-N
Synonyms

(2HBENZO(34D)13DIOXOLAN5YLAMINO)((46DIMETHYL(2PYRIDYL))AMINO)METHANE1THIONE
1(13benzodioxol5yl)3(46dimethylpyridin2yl)thiourea
CC1=CC(=NC(=C1)NC(=S)NC2=CC3=C(C=C2)OCO3)C
InChI=1SC15H15N3O2Sc19510(2)1614(69)1815(21)1711341213(711)2081912h37H8H212H3(H216171821)
MFCD04220281
ZINC000000609732
ZINC00609732
ZINC609732

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Available files

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