Vitas-M small molecule compound
3-(7-methoxy-1-benzofuran-2-yl)-5-[(2-phenoxyethyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Catalog ID
STK506292
SMILES C=CCn1c(SCCOc2ccccc2)nnc1c1cc2c(o1)c(OC)ccc2
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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 C22H21N3O3S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S/c1-3-12-25-21(19-15-16-8-7-11-18(26-2)20(16)28-19)23-24-22(25)29-14-13-27-17-9-5-4-6-10-17/h3-11,15H,1,12-14H2,2H3InChIKey
QZTMLFLQTLTKQT-UHFFFAOYSA-NSynonyms
3(7methoxy1benzofuran2yl)5((2phenoxyethyl)sulfanyl)4(prop2en1yl)4H124triazole
3(7methoxy1benzofuran2yl)5(2phenoxyethylsulfanyl)4prop2enyl124triazole
COC1=CC=CC2=C1OC(=C2)C3=NN=C(N3CC=C)SCCOC4=CC=CC=C4
InChI=1SC22H21N3O3Sc13122521(191516871118(262)20(16)2819)232422(25)291413271795461017h31115H11214H22H3
MFCD13368913
ZINC000035655187
ZINC35655187
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