Vitas-M small molecule compound

2-[(2,3-dimethylphenoxy)acetyl]-N-methylhydrazinecarbothioamide

Catalog ID
STK445181
SMILES CNC(=S)NNC(=O)COc1cccc(c1C)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 C12H17N3O2S MW 267.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17N3O2S/c1-8-5-4-6-10(9(8)2)17-7-11(16)14-15-12(18)13-3/h4-6H,7H2,1-3H3,(H,14,16)(H2,13,15,18)
InChIKey
YRCCSLFBBKQNKB-UHFFFAOYSA-N
Synonyms

1((2(23DIMETHYLPHENOXY)ACETYL)AMINO)3METHYLTHIOUREA
2((23dimethylphenoxy)acetyl)Nmethylhydrazinecarbothioamide
2(23DIMETHYLPHENOXY)N(((METHYLAMINO)THIOXOMETHYL)AMINO)ACETAMIDE
CC1=C(C(=CC=C1)OCC(=O)NNC(=S)NC)C
InChI=1SC12H17N3O2Sc1854610(9(8)2)17711(16)141512(18)133h46H7H213H3(H1416)(H2131518)
MFCD04057928
ZINC000008682462
ZINC08682462
ZINC8682462

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Available files

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