Vitas-M small molecule compound
3-[(2,6-dichlorobenzyl)sulfanyl]-4-methyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazole
Catalog ID
STK126552
SMILES Cc1ccccc1OCc1nnc(n1C)SCc1c(Cl)cccc1Cl
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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 C18H17Cl2N3OS MW 394.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl2N3OS/c1-12-6-3-4-9-16(12)24-10-17-21-22-18(23(17)2)25-11-13-14(19)7-5-8-15(13)20/h3-9H,10-11H2,1-2H3InChIKey
NTWFQVVSKDKOEZ-UHFFFAOYSA-NSynonyms
3((26DICHLOROBENZYL)SULFANYL)4METHYL5((2METHYLPHENOXY)METHYL)4H124TRIAZOLE
3((26DICHLOROPHENYL)METHYLSULFANYL)4METHYL5((2METHYLPHENOXY)METHYL)124TRIAZOLE
CC1=CC=CC=C1OCC2=NN=C(N2C)SCC3=C(C=CC=C3Cl)Cl
InChI=1SC18H17Cl2N3OSc112634916(12)241017212218(23(17)2)25111314(19)75815(13)20h39H1011H212H3
MFCD04363473
ZINC000004700100
ZINC04700100
ZINC4700100
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