Vitas-M small molecule compound

1-(4-bromophenyl)-2-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STK130892
SMILES Brc1ccc(cc1)C(=O)CSc1nnc(n1C)c1ccco1

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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 C15H12BrN3O2S MW 378.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12BrN3O2S/c1-19-14(13-3-2-8-21-13)17-18-15(19)22-9-12(20)10-4-6-11(16)7-5-10/h2-8H,9H2,1H3
InChIKey
LABLZKSZGSYJKL-UHFFFAOYSA-N
Synonyms
384859-08-9
1(4BROMOPHENYL)2((5(2FURYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(4bromophenyl)2((5(furan2yl)4methyl124triazol3yl)sulfanyl)ethanone
1(4BROMOPHENYL)2((5(FURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)ETHAN1ONE
1(4BROMOPHENYL)2((5(FURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(4bromophenyl)2((5(furan2yl)4methyl4H124triazol3yl)thio)ethanone
1(4BROMOPHENYL)2(5(2FURYL)4METHYL(124TRIAZOL3YLTHIO))ETHAN1ONE
1(4BROMOPHENYL)2(5FURAN2YL4METHYL4H(124)TRIAZOL3YLSULFANYL)ETHANONE
384859089
CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Br)C3=CC=CO3
InChI=1SC15H12BrN3O2Sc11914(133282113)171815(19)22912(20)104611(16)7510h28H9H21H3
MFCD02625814
ZINC000000969373
ZINC00969373
ZINC969373

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.