Vitas-M small molecule compound

4-[3-(diethylamino)propyl]-5-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol

Catalog ID
STL396751
SMILES CCN(CCCn1c(nnc1S)CCn1nc(cc1C)[N+](=O)[O-])CC

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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 C15H25N7O2S MW 367.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H25N7O2S/c1-4-19(5-2)8-6-9-20-13(16-17-15(20)25)7-10-21-12(3)11-14(18-21)22(23)24/h11H,4-10H2,1-3H3,(H,17,25)
InChIKey
UUJSUPBOGFOAPH-UHFFFAOYSA-N
Synonyms
1005699-33-1
1005699331
4(3(DIETHYLAMINO)PROPYL)3(2(5METHYL3NITROPYRAZOL1YL)ETHYL)1H124TRIAZOLE5THIONE
4(3(DIETHYLAMINO)PROPYL)5(2(5METHYL3NITRO1HPYRAZOL1YL)ETHYL)4H124TRIAZOLE3THIOL
CCN(CC)CCCN1C(=NNC1=S)CCN2C(=CC(=N2)(N+)(=O)(O))C
CCN(CCCn1c(nnc1S)CCn1nc(cc1C)(N+)(=O)(O))CC
InChI=1SC15H25N7O2Sc1419(52)8692013(161715(20)25)7102112(3)1114(1821)22(23)24h11H410H213H3(H1725)
MFCD04056305
ZINC000007263588
ZINC7263588

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Available files

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