Vitas-M small molecule compound

2-{[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}acetohydrazide

Catalog ID
STK101472
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)N/N=C/c1ccccc1C(F)(F)F

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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 C26H22F3N5O2S MW 525.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22F3N5O2S/c1-17-7-11-20(12-8-17)34-24(18-9-13-21(36-2)14-10-18)32-33-25(34)37-16-23(35)31-30-15-19-5-3-4-6-22(19)26(27,28)29/h3-15H,16H2,1-2H3,(H,31,35)/b30-15+
InChIKey
RRAOEUHXKQEESX-FJEPWZHXSA-N
Synonyms
496773-01-4
(E)2((5(4methoxyphenyl)4(ptolyl)4H124triazol3yl)thio)N(2(trifluoromethyl)benzylidene)acetohydrazide
2((5(4METHOXYPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(2(TRIFLUOROMETHYL)PHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4METHOXYPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(2(TRIFLUOROMETHYL)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
496773014
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=CC=C3C(F)(F)F)C4=CC=C(C=C4)OC
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)NN=Cc1ccccc1C(F)(F)F
InChI=1SC26H22F3N5O2Sc11771120(12817)3424(1891321(362)141018)323325(34)371623(35)31301519534622(19)26(2728)29h315H16H212H3(H3135)b3015+
MFCD03220462
ZINC000001819868
ZINC101504609

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Available files

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