Vitas-M small molecule compound

N-[4-chloro-2-(trifluoromethyl)phenyl]-2-({5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

Catalog ID
STL056050
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2C(F)(F)F)Cl)nnc1COc1ccc(cc1)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 C22H20ClF3N4O2S MW 496.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClF3N4O2S/c1-3-10-30-19(12-32-16-7-4-14(2)5-8-16)28-29-21(30)33-13-20(31)27-18-9-6-15(23)11-17(18)22(24,25)26/h3-9,11H,1,10,12-13H2,2H3,(H,27,31)
InChIKey
HTSPWHPPXQINJC-UHFFFAOYSA-N
Synonyms
849028-72-4
2((4allyl5((ptolyloxy)methyl)4H124triazol3yl)thio)N(4chloro2(trifluoromethyl)phenyl)acetamide
849028724
CC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC(=O)NC3=C(C=C(C=C3)Cl)C(F)(F)F
InChI=1SC22H20ClF3N4O2Sc13103019(1232167414(2)5816)282921(30)331320(31)27189615(23)1117(18)22(2425)26h3911H1101213H22H3(H2731)
MFCD05681669
N(4chloro2(trifluoromethyl)phenyl)2((5((4methylphenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(4CHLORO2(TRIFLUOROMETHYL)PHENYL)2((5((4METHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4CHLORO2(TRIFLUOROMETHYL)PHENYL)2((5(4METHYLPHENOXYMETHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4CHLORO2(TRIFLUOROMETHYL)PHENYL)2(5((4METHYLPHENOXY)METHYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002453874
ZINC02453874
ZINC2453874

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Available files

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