Vitas-M small molecule compound

4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-{5-[(3-methylphenoxy)methyl]furan-2-yl}-4H-1,2,4-triazole-3-thiol

Catalog ID
STK309057
SMILES Cc1cccc(c1)OCc1ccc(o1)c1nnc(n1c1cn(nc1C)C)S

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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 C19H19N5O2S MW 381.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O2S/c1-12-5-4-6-14(9-12)25-11-15-7-8-17(26-15)18-20-21-19(27)24(18)16-10-23(3)22-13(16)2/h4-10H,11H2,1-3H3,(H,21,27)
InChIKey
BRXNUNXNFHFREM-UHFFFAOYSA-N
Synonyms
1005558-04-2
1005558042
4(13dimethyl1Hpyrazol4yl)5(5((3methylphenoxy)methyl)furan2yl)4H124triazole3thiol
4(13dimethylpyrazol4yl)3(5((3methylphenoxy)methyl)furan2yl)1H124triazole5thione
CC1=CC(=CC=C1)OCC2=CC=C(O2)C3=NNC(=S)N3C4=CN(N=C4C)C
InChI=1SC19H19N5O2Sc11254614(912)2511157817(2615)18202119(27)24(18)161023(3)2213(16)2h410H11H213H3(H2127)
MFCD04133382
ZINC000002799383
ZINC02799383
ZINC2799383

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Available files

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