Vitas-M small molecule compound
2-({5-[(2,6-dimethylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-fluorophenyl)acetamide
Catalog ID
STK153105
SMILES C=CCn1c(SCC(=O)Nc2ccccc2F)nnc1COc1c(C)cccc1C
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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 C22H23FN4O2S MW 426.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN4O2S/c1-4-12-27-19(13-29-21-15(2)8-7-9-16(21)3)25-26-22(27)30-14-20(28)24-18-11-6-5-10-17(18)23/h4-11H,1,12-14H2,2-3H3,(H,24,28)InChIKey
ZXQCVWGCQHRMGE-UHFFFAOYSA-NSynonyms
2((5((26DIMETHYLPHENOXY)METHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(2FLUOROPHENYL)ACETAMIDE
2((5((26DIMETHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(2FLUOROPHENYL)ACETAMIDE
CC1=C(C(=CC=C1)C)OCC2=NN=C(N2CC=C)SCC(=O)NC3=CC=CC=C3F
InChI=1SC22H23FN4O2Sc14122719(13292115(2)87916(21)3)252622(27)301420(28)241811651017(18)23h411H11214H223H3(H2428)
MFCD04390067
ZINC000002859436
ZINC02859436
ZINC2859436
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