Vitas-M small molecule compound

4-(2-chloro-4-fluorobenzyl)-N-cyclopropylpiperazine-1-carbothioamide

Catalog ID
STK489986
SMILES Fc1ccc(c(c1)Cl)CN1CCN(CC1)C(=S)NC1CC1

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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 C15H19ClFN3S MW 327.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19ClFN3S/c16-14-9-12(17)2-1-11(14)10-19-5-7-20(8-6-19)15(21)18-13-3-4-13/h1-2,9,13H,3-8,10H2,(H,18,21)
InChIKey
MHIAKTZPLDUFEM-UHFFFAOYSA-N
Synonyms

(4((2CHLORO4FLUOROPHENYL)METHYL)PIPERAZINYL)(CYCLOPROPYLAMINO)METHANE1THIONE
4((2chloro4fluorophenyl)methyl)Ncyclopropylpiperazine1carbothioamide
4(2chloro4fluorobenzyl)Ncyclopropylpiperazine1carbothioamide
C1CC1NC(=S)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl
InChI=1SC15H19ClFN3Sc1614912(17)2111(14)10195720(8619)15(21)18133413h12913H3810H2(H1821)
MFCD07048309
ZINC000013752395
ZINC13752395

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Available files

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