Vitas-M small molecule compound
4-(1-benzyl-1H-pyrazol-4-yl)-5-(1-ethyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL397218
SMILES CCn1ncc(c1)c1nnc(n1c1cnn(c1)Cc1ccccc1)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 C17H17N7S MW 351.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N7S/c1-2-22-11-14(8-18-22)16-20-21-17(25)24(16)15-9-19-23(12-15)10-13-6-4-3-5-7-13/h3-9,11-12H,2,10H2,1H3,(H,21,25)InChIKey
OKPMDTKMJYFWEZ-UHFFFAOYSA-NSynonyms
1005667-73-11005667731
4(1BENZYL1HPYRAZOL4YL)5(1ETHYL1HPYRAZOL4YL)4H124TRIAZOLE3THIOL
4(1benzylpyrazol4yl)3(1ethylpyrazol4yl)1H124triazole5thione
CCN1C=C(C=N1)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=CC=C4
InChI=1SC17H17N7Sc12221114(81822)16202117(25)24(16)1591923(1215)10136435713h391112H210H21H3(H2125)
MFCD04059478
ZINC000002808796
ZINC02808796
ZINC2808796
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