Vitas-M small molecule compound

N-(2-bromo-4,6-difluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STL052599
SMILES COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1c(F)cc(cc1Br)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 C22H17BrF2N4O3S MW 535.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrF2N4O3S/c1-31-15-5-2-4-13(8-15)21-27-28-22(29(21)11-16-6-3-7-32-16)33-12-19(30)26-20-17(23)9-14(24)10-18(20)25/h2-10H,11-12H2,1H3,(H,26,30)
InChIKey
SSAQXVGEWULNBS-UHFFFAOYSA-N
Synonyms
861645-38-7
861645387
COC1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=C(C=C(C=C4Br)F)F
InChI=1SC22H17BrF2N4O3Sc1311552413(815)21272822(29(21)11166373216)331219(30)262017(23)914(24)1018(20)25h210H1112H21H3(H2630)
MFCD05686196
N(2BROMO46DIFLUOROPHENYL)2((4(FURAN2YLMETHYL)5(3METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2bromo46difluorophenyl)2((4(furan2ylmethyl)5(3methoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
N(2bromo46difluorophenyl)2((4(furan2ylmethyl)5(3methoxyphenyl)4H124triazol3yl)thio)acetamide
N(2BROMO46DIFLUOROPHENYL)2(4(2FURYLMETHYL)5(3METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000097958326
ZINC97958326

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Available files

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