Vitas-M small molecule compound

4-tert-butyl-N-{3-[3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenyl}benzamide

Catalog ID
STL387855
SMILES O=C(c1ccc(cc1)C(C)(C)C)Nc1cccc(c1)c1nn2c(s1)nnc2C(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 C21H18F3N5OS MW 445.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3N5OS/c1-20(2,3)14-9-7-12(8-10-14)16(30)25-15-6-4-5-13(11-15)17-28-29-18(21(22,23)24)26-27-19(29)31-17/h4-11H,1-3H3,(H,25,30)
InChIKey
NOCXLINKNHZELW-UHFFFAOYSA-N
Synonyms

4TERTBUTYLN(3(3(TRIFLUOROMETHYL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)PHENYL)BENZAMIDE
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NN4C(=NN=C4S3)C(F)(F)F
InChI=1SC21H18F3N5OSc120(23)149712(81014)16(30)251564513(1115)17282918(21(2223)24)262719(29)3117h411H13H3(H2530)
MFCD28952650
ZINC000098087281
ZINC98087281

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Available files

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