Vitas-M small molecule compound

1-(1-benzofuran-2-yl)-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STK231826
SMILES COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)c1cc2c(o1)cccc2

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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 C25H19N3O3S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O3S/c1-30-20-13-11-17(12-14-20)24-26-27-25(28(24)19-8-3-2-4-9-19)32-16-21(29)23-15-18-7-5-6-10-22(18)31-23/h2-15H,16H2,1H3
InChIKey
LWUVGWOIYLQGCU-UHFFFAOYSA-N
Synonyms

1(1BENZOFURAN2YL)2((5(4METHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(1benzofuran2yl)2((5(4methoxyphenyl)4phenyl4H124triazol3yl)sulfanyl)ethanone
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)C4=CC5=CC=CC=C5O4
InChI=1SC25H19N3O3Sc13020131117(121420)24262725(28(24)198324919)321621(29)2315187561022(18)3123h215H16H21H3
MFCD05855313
ZINC000001426149
ZINC01426149
ZINC1426149

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Available files

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