Vitas-M small molecule compound

4-benzyl-N-cyclohexylpiperazine-1-carbothioamide

Catalog ID
STK086199
SMILES S=C(N1CCN(CC1)Cc1ccccc1)NC1CCCCC1

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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 C18H27N3S MW 317.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N3S/c22-18(19-17-9-5-2-6-10-17)21-13-11-20(12-14-21)15-16-7-3-1-4-8-16/h1,3-4,7-8,17H,2,5-6,9-15H2,(H,19,22)
InChIKey
ZKGBVYYMEQRBGS-UHFFFAOYSA-N
Synonyms

(CYCLOHEXYLAMINO)(4BENZYLPIPERAZINYL)METHANE1THIONE
4BENZYLNCYCLOHEXYL1PIPERAZINECARBOTHIOAMIDE
4BENZYLNCYCLOHEXYLPIPERAZINE1CARBOTHIOAMIDE
C1CCC(CC1)NC(=S)N2CCN(CC2)CC3=CC=CC=C3
InChI=1SC18H27N3Sc2218(191795261017)21131120(121421)15167314816h1347817H256915H2(H1922)
MFCD02921573
STK086199
ZINC000019597528
ZINC19597528

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Available files

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