Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-fluoro-2-methylphenyl)acetamide
Catalog ID
STK139656
SMILES C=CCn1c(SCC(=O)Nc2cc(F)ccc2C)nnc1c1cc2c(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 C22H19FN4O2S MW 422.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FN4O2S/c1-3-10-27-21(19-11-15-6-4-5-7-18(15)29-19)25-26-22(27)30-13-20(28)24-17-12-16(23)9-8-14(17)2/h3-9,11-12H,1,10,13H2,2H3,(H,24,28)InChIKey
LMGRVDCSUFEYHY-UHFFFAOYSA-NSynonyms
2((5(1BENZOFURAN2YL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(5FLUORO2METHYLPHENYL)ACETAMIDE
2((5(1BENZOFURAN2YL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(5FLUORO2METHYLPHENYL)ACETAMIDE
2(4ALLYL5BENZOFURAN2YL4H(124)TRIAZOL3YLSULFANYL)N(5FLUORO2METHYLPHENYL)ACETAMIDE
CC1=C(C=C(C=C1)F)NC(=O)CSC2=NN=C(N2CC=C)C3=CC4=CC=CC=C4O3
InChI=1SC22H19FN4O2Sc13102721(191115645718(15)2919)252622(27)301320(28)24171216(23)9814(17)2h391112H11013H22H3(H2428)
MFCD05992953
ZINC000002861092
ZINC02861092
ZINC2861092
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