Vitas-M small molecule compound

3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]propanamide

Catalog ID
STK304622
SMILES O=C(Nc1ccc(c2c1non2)N1CCOCC1)CCn1nc(c(c1C1CC1)Br)C(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 C20H20BrF3N6O3 MW 529.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrF3N6O3/c21-15-18(11-1-2-11)30(26-19(15)20(22,23)24)6-5-14(31)25-12-3-4-13(17-16(12)27-33-28-17)29-7-9-32-10-8-29/h3-4,11H,1-2,5-10H2,(H,25,31)
InChIKey
UTJHQXJQILQHQL-UHFFFAOYSA-N
Synonyms
1005705-15-6
1005705156
3(4bromo5cyclopropyl3(trifluoromethyl)1Hpyrazol1yl)N(7(morpholin4yl)213benzoxadiazol4yl)propanamide
3(4BROMO5CYCLOPROPYL3(TRIFLUOROMETHYL)PYRAZOL1YL)N(4MORPHOLIN4YL213BENZOXADIAZOL7YL)PROPANAMIDE
C1CC1C2=C(C(=NN2CCC(=O)NC3=CC=C(C4=NON=C34)N5CCOCC5)C(F)(F)F)Br
InChI=1SC20H20BrF3N6O3c211518(111211)30(2619(15)20(2223)24)6514(31)25123413(1716(12)27332817)29793210829h3411H12510H2(H2531)
MFCD04042804
ZINC000002781519
ZINC2781519

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Available files

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