Vitas-M small molecule compound

4-(3-chlorophenyl)-N-methylpiperazine-1-carbothioamide

Catalog ID
STK807151
SMILES CNC(=S)N1CCN(CC1)c1cccc(c1)Cl

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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 C12H16ClN3S MW 269.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16ClN3S/c1-14-12(17)16-7-5-15(6-8-16)11-4-2-3-10(13)9-11/h2-4,9H,5-8H2,1H3,(H,14,17)
InChIKey
REEZQTXQCOGBJQ-UHFFFAOYSA-N
Synonyms
457093-73-1
(4(3CHLOROPHENYL)PIPERAZINYL)(METHYLAMINO)METHANE1THIONE
4(3CHLOROPHENYL)NMETHYL1PIPERAZINECARBOTHIOAMIDE
4(3chlorophenyl)Nmethylpiperazine1carbothioamide
4(3CHLOROPHENYL)NMETHYLTETRAHYDRO1(2H)PYRAZINECARBOTHIOAMIDE
457093731
CNC(=S)N1CCN(CC1)C2=CC(=CC=C2)Cl
InChI=1SC12H16ClN3Sc11412(17)167515(6816)1142310(13)911h249H58H21H3(H1417)
MFCD01567662
ZINC000000384240
ZINC00384240
ZINC384240

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Available files

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