Vitas-M small molecule compound

N-(4-butylphenyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide

Catalog ID
STK184942
SMILES CCCCc1ccc(cc1)NC(=S)N1CCN(CC1)c1ccc(cc1)O

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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 C21H27N3OS MW 369.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3OS/c1-2-3-4-17-5-7-18(8-6-17)22-21(26)24-15-13-23(14-16-24)19-9-11-20(25)12-10-19/h5-12,25H,2-4,13-16H2,1H3,(H,22,26)
InChIKey
YNNZEESJNNNUAA-UHFFFAOYSA-N
Synonyms

4(4(((4BUTYLPHENYL)AMINO)THIOXOMETHYL)PIPERAZINYL)PHENOL
CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)O
InChI=1SC21H27N3OSc1234175718(8617)2221(26)24151323(141624)1991120(25)121019h51225H241316H21H3(H2226)
MFCD04058687
N(4BUTYLPHENYL)4(4HYDROXYPHENYL)PIPERAZINE1CARBOTHIOAMIDE
ZINC000004710994
ZINC04710994
ZINC4710994

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Available files

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