Vitas-M small molecule compound

3-[(3-methoxybenzyl)sulfanyl]-4-methyl-5-[4-(2-methylpropoxy)phenyl]-4H-1,2,4-triazole

Catalog ID
STK484151
SMILES COc1cccc(c1)CSc1nnc(n1C)c1ccc(cc1)OCC(C)C

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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 C21H25N3O2S MW 383.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O2S/c1-15(2)13-26-18-10-8-17(9-11-18)20-22-23-21(24(20)3)27-14-16-6-5-7-19(12-16)25-4/h5-12,15H,13-14H2,1-4H3
InChIKey
QZWGGPOFIVSCEL-UHFFFAOYSA-N
Synonyms

1METHOXY3((4METHYL5(4(2METHYLPROPOXY)PHENYL)(124TRIAZOL3YLTHIO))METHYL)BENZENE
3((3methoxybenzyl)sulfanyl)4methyl5(4(2methylpropoxy)phenyl)4H124triazole
3((3methoxyphenyl)methylsulfanyl)4methyl5(4(2methylpropoxy)phenyl)124triazole
CC(C)COC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC(=CC=C3)OC
InChI=1SC21H25N3O2Sc115(2)13261810817(91118)20222321(24(20)3)27141665719(1216)254h51215H1314H214H3
MFCD07079404
ZINC000013325580
ZINC13325580

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Available files

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