Vitas-M small molecule compound

4-(2-methylpropyl)-5-[(5-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol

Catalog ID
STK306422
SMILES CC(Cn1c(S)nnc1Cn1nccc1C)C

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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 C11H17N5S MW 251.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H17N5S/c1-8(2)6-15-10(13-14-11(15)17)7-16-9(3)4-5-12-16/h4-5,8H,6-7H2,1-3H3,(H,14,17)
InChIKey
XBKADOJGLQVCSR-UHFFFAOYSA-N
Synonyms
1002205-07-3
1002205073
4(2methylpropyl)3((5methylpyrazol1yl)methyl)1H124triazole5thione
4(2methylpropyl)5((5methyl1Hpyrazol1yl)methyl)4H124triazole3thiol
4(2METHYLPROPYL)5((5METHYLPYRAZOLYL)METHYL)124TRIAZOLE3THIOL
4ISOBUTYL5(5METHYLPYRAZOL1YLMETHYL)4H
4ISOBUTYL5(5METHYLPYRAZOL1YLMETHYL)4H(124)TRIAZOLE3THIOL
CC1=CC=NN1CC2=NNC(=S)N2CC(C)C
InChI=1SC11H17N5Sc18(2)61510(131411(15)17)7169(3)451216h458H67H213H3(H1417)
MFCD04967144
ZINC000002534206
ZINC02534206
ZINC2534206

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Available files

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