Vitas-M small molecule compound
4-[1-(4-methylbenzyl)-1H-pyrazol-4-yl]-5-(2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL396167
SMILES Cc1ccc(cc1)Cn1ncc(c1)n1c(S)nnc1C1CC1c1ccccc1
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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 C22H21N5S MW 387.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5S/c1-15-7-9-16(10-8-15)13-26-14-18(12-23-26)27-21(24-25-22(27)28)20-11-19(20)17-5-3-2-4-6-17/h2-10,12,14,19-20H,11,13H2,1H3,(H,25,28)InChIKey
YTFLSCDIQVSNHX-UHFFFAOYSA-NSynonyms
1005574-85-51005574855
4(1((4methylphenyl)methyl)pyrazol4yl)3(2phenylcyclopropyl)1H124triazole5thione
4(1(4METHYLBENZYL)1HPYRAZOL4YL)5(2PHENYLCYCLOPROPYL)4H124TRIAZOLE3THIOL
CC1=CC=C(C=C1)CN2C=C(C=N2)N3C(=NNC3=S)C4CC4C5=CC=CC=C5
InChI=1SC22H21N5Sc1157916(10815)13261418(122326)2721(242522(27)28)201119(20)175324617h21012141920H1113H21H3(H2528)
MFCD04058965
ZINC000002808332
ZINC000002808335
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