Vitas-M small molecule compound

4-(2,4-dimethoxyphenyl)-5-{4-[(4-ethoxyphenoxy)methyl]phenyl}-4H-1,2,4-triazole-3-thiol

Catalog ID
STK307335
SMILES CCOc1ccc(cc1)OCc1ccc(cc1)c1nnc(n1c1ccc(cc1OC)OC)S

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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 C25H25N3O4S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S/c1-4-31-19-9-11-20(12-10-19)32-16-17-5-7-18(8-6-17)24-26-27-25(33)28(24)22-14-13-21(29-2)15-23(22)30-3/h5-15H,4,16H2,1-3H3,(H,27,33)
InChIKey
AKNOMNYCJSDFOV-UHFFFAOYSA-N
Synonyms
828291-50-5
4(24DIMETHOXYPHENYL)3(4((4ETHOXYPHENOXY)METHYL)PHENYL)1H124TRIAZOLE5THIONE
4(24dimethoxyphenyl)5(4((4ethoxyphenoxy)methyl)phenyl)4H124triazole3thiol
828291505
CCOC1=CC=C(C=C1)OCC2=CC=C(C=C2)C3=NNC(=S)N3C4=C(C=C(C=C4)OC)OC
InChI=1SC25H25N3O4Sc14311991120(121019)3216175718(8617)24262725(33)28(24)22141321(292)1523(22)303h515H416H213H3(H2733)
MFCD04049748
ZINC000002793466
ZINC2793466

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Available files

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