Vitas-M small molecule compound

2-{[5-(3-chloro-1-benzothiophen-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone

Catalog ID
STK807513
SMILES COc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nnc1c1sc2c(c1Cl)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 C25H18ClN3O2S2 MW 492.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClN3O2S2/c1-31-18-13-11-17(12-14-18)29-24(23-22(26)19-9-5-6-10-21(19)33-23)27-28-25(29)32-15-20(30)16-7-3-2-4-8-16/h2-14H,15H2,1H3
InChIKey
QLSJUGSOZJKSRX-UHFFFAOYSA-N
Synonyms

2((5(3CHLORO1BENZOTHIOPHEN2YL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((5(3chloro1benzothiophen2yl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)1phenylethanone
COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=CC=C3)C4=C(C5=CC=CC=C5S4)Cl
InChI=1SC25H18ClN3O2S2c13118131117(121418)2924(2322(26)199561021(19)3323)272825(29)321520(30)167324816h214H15H21H3
MFCD06260375
ZINC000002671184
ZINC02671184
ZINC2671184

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Available files

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