Vitas-M small molecule compound

4-(3-hydroxyphenyl)-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide

Catalog ID
STK446477
SMILES Oc1cccc(c1)N1CCN(CC1)C(=S)NCC1CCCO1

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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 C16H23N3O2S MW 321.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N3O2S/c20-14-4-1-3-13(11-14)18-6-8-19(9-7-18)16(22)17-12-15-5-2-10-21-15/h1,3-4,11,15,20H,2,5-10,12H2,(H,17,22)
InChIKey
AIQZDUUDSZUWJA-UHFFFAOYSA-N
Synonyms

3(4(((OXOLAN2YLMETHYL)AMINO)THIOXOMETHYL)PIPERAZINYL)PHENOL
4(3hydroxyphenyl)N(oxolan2ylmethyl)piperazine1carbothioamide
4(3hydroxyphenyl)N(tetrahydrofuran2ylmethyl)piperazine1carbothioamide
C1CC(OC1)CNC(=S)N2CCN(CC2)C3=CC(=CC=C3)O
InChI=1SC16H23N3O2Sc201441313(1114)186819(9718)16(22)17121552102115h134111520H251012H2(H1722)
MFCD04058606
ZINC000001460297
ZINC000001460298

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Available files

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