Vitas-M small molecule compound

3-(1-benzofuran-2-yl)-5-(benzylsulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole

Catalog ID
STK917694
SMILES C=CCn1c(SCc2ccccc2)nnc1c1cc2c(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 C20H17N3OS MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3OS/c1-2-12-23-19(18-13-16-10-6-7-11-17(16)24-18)21-22-20(23)25-14-15-8-4-3-5-9-15/h2-11,13H,1,12,14H2
InChIKey
JCVAXOWYMFAEIH-UHFFFAOYSA-N
Synonyms
585555-42-6
3(1benzofuran2yl)5(benzylsulfanyl)4(prop2en1yl)4H124triazole
3(1BENZOFURAN2YL)5BENZYLSULFANYL4PROP2ENYL124TRIAZOLE
4allyl3(benzofuran2yl)5(benzylthio)4H124triazole
585555426
C=CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CC4=CC=CC=C4O3
InChI=1SC20H17N3OSc12122319(18131610671117(16)2418)212220(23)2514158435915h21113H11214H2
MFCD04030141
ZINC000000532463
ZINC00532463
ZINC532463

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Available files

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