Vitas-M small molecule compound

2-[2-(2,5-dichlorophenoxy)butanoyl]-N-ethylhydrazinecarbothioamide

Catalog ID
STK433974
SMILES CCC(C(=O)NNC(=S)NCC)Oc1cc(Cl)ccc1Cl

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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 C13H17Cl2N3O2S MW 350.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17Cl2N3O2S/c1-3-10(12(19)17-18-13(21)16-4-2)20-11-7-8(14)5-6-9(11)15/h5-7,10H,3-4H2,1-2H3,(H,17,19)(H2,16,18,21)
InChIKey
BPAAJYJTTFWNBS-UHFFFAOYSA-N
Synonyms

1(2(25DICHLOROPHENOXY)BUTANOYLAMINO)3ETHYLTHIOUREA
2(2(25dichlorophenoxy)butanoyl)Nethylhydrazinecarbothioamide
2(25DICHLOROPHENOXY)N(((ETHYLAMINO)THIOXOMETHYL)AMINO)BUTANAMIDE
CCC(C(=O)NNC(=S)NCC)OC1=C(C=CC(=C1)Cl)Cl
InChI=1SC13H17Cl2N3O2Sc1310(12(19)171813(21)1642)201178(14)569(11)15h5710H34H212H3(H1719)(H2161821)
MFCD03943492
ZINC000006678175
ZINC000006707085

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Available files

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