Vitas-M small molecule compound

2-[(2,5-dimethylphenoxy)acetyl]-N-methylhydrazinecarbothioamide

Catalog ID
STK434099
SMILES CNC(=S)NNC(=O)COc1cc(C)ccc1C

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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 C12H17N3O2S MW 267.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17N3O2S/c1-8-4-5-9(2)10(6-8)17-7-11(16)14-15-12(18)13-3/h4-6H,7H2,1-3H3,(H,14,16)(H2,13,15,18)
InChIKey
HOSYZNFKONEPQE-UHFFFAOYSA-N
Synonyms

1((2(25DIMETHYLPHENOXY)ACETYL)AMINO)3METHYLTHIOUREA
2((25dimethylphenoxy)acetyl)Nmethylhydrazinecarbothioamide
2(25DIMETHYLPHENOXY)N(((METHYLAMINO)THIOXOMETHYL)AMINO)ACETAMIDE
CC1=CC(=C(C=C1)C)OCC(=O)NNC(=S)NC
InChI=1SC12H17N3O2Sc18459(2)10(68)17711(16)141512(18)133h46H7H213H3(H1416)(H2131518)
MFCD03943407
ZINC000007556246
ZINC07556246
ZINC7556246

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Available files

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