Vitas-M small molecule compound

2-[2-(3,4-dimethylphenoxy)propanoyl]-N-(prop-2-en-1-yl)hydrazinecarbothioamide

Catalog ID
STK414005
SMILES C=CCNC(=S)NNC(=O)C(Oc1ccc(c(c1)C)C)C

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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 C15H21N3O2S MW 307.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21N3O2S/c1-5-8-16-15(21)18-17-14(19)12(4)20-13-7-6-10(2)11(3)9-13/h5-7,9,12H,1,8H2,2-4H3,(H,17,19)(H2,16,18,21)
InChIKey
WAADFWWHVANJTE-UHFFFAOYSA-N
Synonyms

1(2(34dimethylphenoxy)propanoylamino)3prop2enylthiourea
2(2(34dimethylphenoxy)propanoyl)N(prop2en1yl)hydrazinecarbothioamide
2(34DIMETHYLPHENOXY)N(((PROP2ENYLAMINO)THIOXOMETHYL)AMINO)PROPANAMIDE
CC1=C(C=C(C=C1)OC(C)C(=O)NNC(=S)NCC=C)C
InChI=1SC15H21N3O2Sc1581615(21)181714(19)12(4)20137610(2)11(3)913h57912H18H224H3(H1719)(H2161821)
MFCD04057816
ZINC000006788745
ZINC000006788748

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Available files

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