Vitas-M small molecule compound

4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-5-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK309830
SMILES CCn1ncc(c1C)n1c(nnc1S)CC12CC3CC(C2)CC(C1)C3

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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 C19H27N5S MW 357.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27N5S/c1-3-23-12(2)16(11-20-23)24-17(21-22-18(24)25)10-19-7-13-4-14(8-19)6-15(5-13)9-19/h11,13-15H,3-10H2,1-2H3,(H,22,25)
InChIKey
VQPGHHIQRDHJSW-UHFFFAOYSA-N
Synonyms
1005699-34-2
1005699342
3(1ADAMANTYLMETHYL)4(1ETHYL5METHYLPYRAZOL4YL)1H124TRIAZOLE5THIONE
4(1ethyl5methyl1Hpyrazol4yl)5(tricyclo(3311~37~)dec1ylmethyl)4H124triazole3thiol
5(ADAMANTANYLMETHYL)4(1ETHYL5METHYLPYRAZOL4YL)124TRIAZOLE3THIOL
CCN1C(=C(C=N1)N2C(=NNC2=S)CC34CC5CC(C3)CC(C5)C4)C
InChI=1SC19H27N5Sc132312(2)16(112023)2417(212218(24)25)1019713414(819)615(513)919h111315H310H212H3(H2225)
MFCD04134048
ZINC000008339739
ZINC8339739

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Available files

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