Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylcyclohexyl)acetamide
Catalog ID
STL122578
SMILES O=C(NC1CCCCC1C)CSc1nnc(n1C(C)C)c1cc2c(o1)cccc2
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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 C22H28N4O2S MW 412.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O2S/c1-14(2)26-21(19-12-16-9-5-7-11-18(16)28-19)24-25-22(26)29-13-20(27)23-17-10-6-4-8-15(17)3/h5,7,9,11-12,14-15,17H,4,6,8,10,13H2,1-3H3,(H,23,27)InChIKey
WZQZMJLQGYEIDB-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4(propan2yl)4H124triazol3yl)sulfanyl)N(2methylcyclohexyl)acetamide
2((5(1benzofuran2yl)4propan2yl124triazol3yl)sulfanyl)N(2methylcyclohexyl)acetamide
CC1CCCCC1NC(=O)CSC2=NN=C(N2C(C)C)C3=CC4=CC=CC=C4O3
InChI=1SC22H28N4O2Sc114(2)2621(1912169571118(16)2819)242522(26)291320(27)23171064815(17)3h5791112141517H4681013H213H3(H2327)
MFCD17011672
ZINC000028211374
ZINC000028211384
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