Vitas-M small molecule compound

4-methyl-N-(3-methylphenyl)piperazine-1-carbothioamide

Catalog ID
STK078006
SMILES CN1CCN(CC1)C(=S)Nc1cccc(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 C13H19N3S MW 249.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19N3S/c1-11-4-3-5-12(10-11)14-13(17)16-8-6-15(2)7-9-16/h3-5,10H,6-9H2,1-2H3,(H,14,17)
InChIKey
PQWMKNIVNZBYHR-UHFFFAOYSA-N
Synonyms
404902-31-4
404902314
4METHYLN(3METHYLPHENYL)PIPERAZINE1CARBOTHIOAMIDE
CC1=CC(=CC=C1)NC(=S)N2CCN(CC2)C
CN1CCN(CC1)C(=S)Nc1cccc(c1)C
InChI=1SC13H19N3Sc11143512(1011)1413(17)168615(2)7916h3510H69H212H3(H1417)
MFCD02756760
STK078006
ZINC000000452878
ZINC452878

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Available files

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