Vitas-M small molecule compound
5-({[5-(1-methyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-4-(1-phenylethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306989
SMILES Cn1ccc(n1)c1nnc(n1CC1CCCO1)SCc1nnc(n1C(c1ccccc1)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 C22H26N8OS2 MW 482.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N8OS2/c1-15(16-7-4-3-5-8-16)30-19(23-25-21(30)32)14-33-22-26-24-20(18-10-11-28(2)27-18)29(22)13-17-9-6-12-31-17/h3-5,7-8,10-11,15,17H,6,9,12-14H2,1-2H3,(H,25,32)InChIKey
JBNRDNDSFSRLKU-UHFFFAOYSA-NSynonyms
1005633-71-51005633715
3((5(1METHYLPYRAZOL3YL)4(OXOLAN2YLMETHYL)124TRIAZOL3YL)SULFANYLMETHYL)4(1PHENYLETHYL)1H124TRIAZOLE5THIONE
5(((5(1methyl1Hpyrazol3yl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)methyl)4(1phenylethyl)4H124triazole3thiol
CC(C1=CC=CC=C1)N2C(=NNC2=S)CSC3=NN=C(N3CC4CCCO4)C5=NN(C=C5)C
InChI=1SC22H26N8OS2c115(167435816)3019(232521(30)32)143322262420(18101128(2)2718)29(22)131796123117h357810111517H691214H212H3(H2532)
MFCD04053648
ZINC000002792399
ZINC000002792402
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