Vitas-M small molecule compound

3-[(4-bromobenzyl)sulfanyl]-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole

Catalog ID
STL041614
SMILES Brc1ccc(cc1)CSc1nnc(n1Cc1ccco1)c1ccccc1F

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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 C20H15BrFN3OS MW 444.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrFN3OS/c21-15-9-7-14(8-10-15)13-27-20-24-23-19(17-5-1-2-6-18(17)22)25(20)12-16-4-3-11-26-16/h1-11H,12-13H2
InChIKey
MPEFPYVSJSGCNK-UHFFFAOYSA-N
Synonyms
712283-94-8
3((4BROMOBENZYL)SULFANYL)5(2FLUOROPHENYL)4(FURAN2YLMETHYL)4H124TRIAZOLE
3((4bromobenzyl)thio)5(2fluorophenyl)4(furan2ylmethyl)4H124triazole
3((4BROMOPHENYL)METHYLSULFANYL)5(2FLUOROPHENYL)4(FURAN2YLMETHYL)124TRIAZOLE
712283948
C1=CC=C(C(=C1)C2=NN=C(N2CC3=CC=CO3)SCC4=CC=C(C=C4)Br)F
InChI=1SC20H15BrFN3OSc21159714(81015)132720242319(17512618(17)22)25(20)121643112616h111H1213H2
MFCD05679631
ZINC000001058132
ZINC01058132
ZINC1058132

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Available files

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