Vitas-M small molecule compound

N-(4-fluorobenzyl)-4-methyl-1H-pyrazole-1-carbothioamide

Catalog ID
STK487205
SMILES Fc1ccc(cc1)CNC(=S)n1ncc(c1)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 C12H12FN3S MW 249.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12FN3S/c1-9-6-15-16(8-9)12(17)14-7-10-2-4-11(13)5-3-10/h2-6,8H,7H2,1H3,(H,14,17)
InChIKey
RZKPOADLRCRHGN-UHFFFAOYSA-N
Synonyms

(((4FLUOROPHENYL)METHYL)AMINO)(4METHYLPYRAZOLYL)METHANE1THIONE
CC1=CN(N=C1)C(=S)NCC2=CC=C(C=C2)F
InChI=1SC12H12FN3Sc1961516(89)12(17)147102411(13)5310h268H7H21H3(H1417)
MFCD06114580
N((4fluorophenyl)methyl)4methylpyrazole1carbothioamide
N(4fluorobenzyl)4methyl1Hpyrazole1carbothioamide
ZINC000013330997
ZINC13330997

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Available files

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