Vitas-M small molecule compound
2-({5-[(2-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trichlorophenyl)acetamide
Catalog ID
STK219653
SMILES C=CCn1c(SCC(=O)Nc2c(Cl)cc(cc2Cl)Cl)nnc1COc1ccccc1C
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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 C21H19Cl3N4O2S MW 497.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl3N4O2S/c1-3-8-28-18(11-30-17-7-5-4-6-13(17)2)26-27-21(28)31-12-19(29)25-20-15(23)9-14(22)10-16(20)24/h3-7,9-10H,1,8,11-12H2,2H3,(H,25,29)InChIKey
GISGXFPGFUYZOJ-UHFFFAOYSA-NSynonyms
2((5((2METHYLPHENOXY)METHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(246TRICHLOROPHENYL)ACETAMIDE
2((5((2METHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(246TRICHLOROPHENYL)ACETAMIDE
CC1=CC=CC=C1OCC2=NN=C(N2CC=C)SCC(=O)NC3=C(C=C(C=C3Cl)Cl)Cl
InChI=1SC21H19Cl3N4O2Sc1382818(113017754613(17)2)262721(28)311219(29)252015(23)914(22)1016(20)24h37910H181112H22H3(H2529)
MFCD04386935
ZINC000002881075
ZINC02881075
ZINC2881075
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