Vitas-M small molecule compound

1-(2,5-dimethoxyphenyl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STK097345
SMILES CCOc1ccc(cc1)n1c(SCC(=O)c2cc(OC)ccc2OC)nnc1c1cccnc1

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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 C25H24N4O4S MW 476.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O4S/c1-4-33-19-9-7-18(8-10-19)29-24(17-6-5-13-26-15-17)27-28-25(29)34-16-22(30)21-14-20(31-2)11-12-23(21)32-3/h5-15H,4,16H2,1-3H3
InChIKey
SYMHMMUGGGTHJJ-UHFFFAOYSA-N
Synonyms
477329-67-2
1(25DIMETHOXYPHENYL)2((4(4ETHOXYPHENYL)5(PYRIDIN3YL)4H124TRIAZOL3YL)SULFANYL)ETHAN1ONE
1(25DIMETHOXYPHENYL)2((4(4ETHOXYPHENYL)5(PYRIDIN3YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(25DIMETHOXYPHENYL)2((4(4ETHOXYPHENYL)5(PYRIDIN3YL)4H124TRIAZOL3YL)THIO)ETHANONE
1(25DIMETHOXYPHENYL)2((4(4ETHOXYPHENYL)5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)ETHANONE
477329672
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=C(C=CC(=C3)OC)OC)C4=CN=CC=C4
CCOc1ccc(cc1)n1c(SCC(=O)c2cc(OC)ccc2OC)nnc1c1cccnc1
InChI=1SC25H24N4O4Sc1433199718(81019)2924(176513261517)272825(29)341622(30)211420(312)111223(21)323h515H416H213H3
MFCD03225102
STK097345
ZINC000001306374
ZINC01306374
ZINC1306374

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Available files

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