Vitas-M small molecule compound
N-cyclohexyl-2-({5-[(2,4-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK221887
SMILES O=C(NC1CCCCC1)CSc1nnc(n1C)COc1ccc(cc1C)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 C20H28N4O2S MW 388.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4O2S/c1-14-9-10-17(15(2)11-14)26-12-18-22-23-20(24(18)3)27-13-19(25)21-16-7-5-4-6-8-16/h9-11,16H,4-8,12-13H2,1-3H3,(H,21,25)InChIKey
AFFHKPFDYUYXLG-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)OCC2=NN=C(N2C)SCC(=O)NC3CCCCC3)C
InChI=1SC20H28N4O2Sc11491017(15(2)1114)261218222320(24(18)3)271319(25)21167546816h91116H481213H213H3(H2125)
MFCD07045366
NCYCLOHEXYL2((5((24DIMETHYLPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
NCYCLOHEXYL2((5((24DIMETHYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000004816224
ZINC04816224
ZINC4816224
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