Vitas-M small molecule compound

2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide

Catalog ID
STK069369
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nnc1c1ccc(cc1)C(C)(C)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 C28H26ClF3N4O2S MW 575.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClF3N4O2S/c1-27(2,3)18-7-5-17(6-8-18)25-34-35-26(36(25)20-10-12-21(38-4)13-11-20)39-16-24(37)33-23-15-19(28(30,31)32)9-14-22(23)29/h5-15H,16H2,1-4H3,(H,33,37)
InChIKey
GVPYTDDFKHOZSW-UHFFFAOYSA-N
Synonyms

2((5(4(tertbutyl)phenyl)4(4methoxyphenyl)4H124triazol3yl)thio)N(2chloro5(trifluoromethyl)phenyl)acetamide
2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2(5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl
COc1ccc(cc1)n1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nnc1c1ccc(cc1)C(C)(C)C
InChI=1SC28H26ClF3N4O2Sc127(23)187517(6818)25343526(36(25)20101221(384)131120)391624(37)33231519(28(3031)32)91422(23)29h515H16H214H3(H3337)
MFCD03223971
STK069369
ZINC000002596188
ZINC2596188

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Available files

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