Vitas-M small molecule compound

4-(pyrimidin-2-yl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide

Catalog ID
STK261789
SMILES COc1cc(NC(=S)N2CCN(CC2)c2ncccn2)cc(c1OC)OC

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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 C18H23N5O3S MW 389.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O3S/c1-24-14-11-13(12-15(25-2)16(14)26-3)21-18(27)23-9-7-22(8-10-23)17-19-5-4-6-20-17/h4-6,11-12H,7-10H2,1-3H3,(H,21,27)
InChIKey
DXRSLBIPZHVGTJ-UHFFFAOYSA-N
Synonyms
879761-22-5
(4PYRIMIDIN2YLPIPERAZINYL)((345TRIMETHOXYPHENYL)AMINO)METHANE1THIONE
4(pyrimidin2yl)N(345trimethoxyphenyl)piperazine1carbothioamide
4PYRIMIDIN2YLN(345TRIMETHOXYPHENYL)PIPERAZINE1CARBOTHIOAMIDE
879761225
COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCN(CC2)C3=NC=CC=N3
InChI=1SC18H23N5O3Sc124141113(1215(252)16(14)263)2118(27)239722(81023)17195462017h461112H710H213H3(H2127)
MFCD07084324
ZINC000004838923
ZINC04838923
ZINC4838923

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Available files

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