Vitas-M small molecule compound
3-[4-(cyclopentyloxy)phenyl]-5-[(3,4-dichlorobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Catalog ID
STK473288
SMILES C=CCn1c(nnc1c1ccc(cc1)OC1CCCC1)SCc1ccc(c(c1)Cl)Cl
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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 C23H23Cl2N3OS MW 460.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23Cl2N3OS/c1-2-13-28-22(17-8-10-19(11-9-17)29-18-5-3-4-6-18)26-27-23(28)30-15-16-7-12-20(24)21(25)14-16/h2,7-12,14,18H,1,3-6,13,15H2InChIKey
QAQCMJGGAXZRLE-UHFFFAOYSA-NSynonyms
1(5((34DICHLOROPHENYL)METHYLTHIO)4PROP2ENYL(124TRIAZOL3YL))4CYCLOPENTYLOXYBENZENE
3(4(cyclopentyloxy)phenyl)5((34dichlorobenzyl)sulfanyl)4(prop2en1yl)4H124triazole
3(4cyclopentyloxyphenyl)5((34dichlorophenyl)methylsulfanyl)4prop2enyl124triazole
C=CCN1C(=NN=C1SCC2=CC(=C(C=C2)Cl)Cl)C3=CC=C(C=C3)OC4CCCC4
InChI=1SC23H23Cl2N3OSc12132822(1781019(11917)2918534618)262723(28)30151671220(24)21(25)1416h27121418H1361315H2
MFCD07030549
ZINC000020161308
ZINC20161308
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