Vitas-M small molecule compound

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

Catalog ID
STK101230
SMILES O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)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 C25H19ClF3N5OS MW 529.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClF3N5OS/c1-16-6-8-17(9-7-16)23-32-33-24(34(23)20-12-10-19(26)11-13-20)36-15-22(35)31-30-14-18-4-2-3-5-21(18)25(27,28)29/h2-14H,15H2,1H3,(H,31,35)/b30-14+
InChIKey
MDPGBAWMAIOHKQ-AMVVHIIESA-N
Synonyms
488804-33-7
(E)2((4(4chlorophenyl)5(ptolyl)4H124triazol3yl)thio)N(2(trifluoromethyl)benzylidene)acetohydrazide
2((4(4CHLOROPHENYL)5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(2(TRIFLUOROMETHYL)PHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(2(TRIFLUOROMETHYL)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
488804337
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC4=CC=CC=C4C(F)(F)F
InChI=1SC25H19ClF3N5OSc1166817(9716)23323324(34(23)20121019(26)111320)361522(35)31301418423521(18)25(2728)29h214H15H21H3(H3135)b3014+
MFCD03220212
N((1E)2(2(TRIFLUOROMETHYL)PHENYL)1AZAVINYL)2(4(4CHLOROPHENYL)5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)NN=Cc1ccccc1C(F)(F)F
ZINC000002318246
ZINC101504271

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Available files

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