Vitas-M small molecule compound

4-(2-fluorophenyl)-N-methylpiperazine-1-carbothioamide

Catalog ID
STK807152
SMILES CNC(=S)N1CCN(CC1)c1ccccc1F

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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 C12H16FN3S MW 253.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16FN3S/c1-14-12(17)16-8-6-15(7-9-16)11-5-3-2-4-10(11)13/h2-5H,6-9H2,1H3,(H,14,17)
InChIKey
KMAXVDZUFHYELJ-UHFFFAOYSA-N
Synonyms

(4(2FLUOROPHENYL)PIPERAZINYL)(METHYLAMINO)METHANE1THIONE
4(2fluorophenyl)Nmethylpiperazine1carbothioamide
4(2FLUOROPHENYL)PIPERAZINE1CARBOTHIOICACIDMETHYLAMIDE
CNC(=S)N1CCN(CC1)C2=CC=CC=C2F
InChI=1SC12H16FN3Sc11412(17)168615(7916)11532410(11)13h25H69H21H3(H1417)
MFCD02827774
ZINC000000414878
ZINC00414878
ZINC414878

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Available files

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