Vitas-M small molecule compound

3-[3-(4-bromophenyl)-4-(4-fluorophenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-1-ethylpyrrolidine-2,5-dione

Catalog ID
STK778670
SMILES CCN1C(=O)CC(C1=O)n1nc(n(c1=S)c1ccc(cc1)F)c1ccc(cc1)Br

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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 C20H16BrFN4O2S MW 475.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrFN4O2S/c1-2-24-17(27)11-16(19(24)28)26-20(29)25(15-9-7-14(22)8-10-15)18(23-26)12-3-5-13(21)6-4-12/h3-10,16H,2,11H2,1H3
InChIKey
AVBVAPROSCHOEA-UHFFFAOYSA-N
Synonyms

3(3(4BROMOPHENYL)4(4FLUOROPHENYL)5SULFANYLIDENE124TRIAZOL1YL)1ETHYLPYRROLIDINE25DIONE
3(3(4bromophenyl)4(4fluorophenyl)5thioxo45dihydro1H124triazol1yl)1ethylpyrrolidine25dione
CCN1C(=O)CC(C1=O)N2C(=S)N(C(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)F
InChI=1SC20H16BrFN4O2Sc122417(27)1116(19(24)28)2620(29)25(159714(22)81015)18(2326)123513(21)6412h31016H211H21H3
MFCD03916318
ZINC000001427960
ZINC000100174377

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Available files

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