Vitas-M small molecule compound
1-{[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,3-dimethylbutan-2-one
Catalog ID
STK579487
SMILES COc1ccc(cc1)n1c(nnc1c1cccc(c1)OC)SCC(=O)C(C)(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 C22H25N3O3S MW 411.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3S/c1-22(2,3)19(26)14-29-21-24-23-20(15-7-6-8-18(13-15)28-5)25(21)16-9-11-17(27-4)12-10-16/h6-13H,14H2,1-5H3InChIKey
IQLUOPMRWCJDGA-UHFFFAOYSA-NSynonyms
848928-20-11((5(3METHOXYPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)33DIMETHYLBUTAN2ONE
1((5(3methoxyphenyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)33dimethylbutan2one
1((5(3methoxyphenyl)4(4methoxyphenyl)4H124triazol3yl)thio)33dimethylbutan2one
1(4(4METHOXYPHENYL)5(3METHOXYPHENYL)(124TRIAZOL3YLTHIO))33DIMETHYLBUTAN2ONE
848928201
CC(C)(C)C(=O)CSC1=NN=C(N1C2=CC=C(C=C2)OC)C3=CC(=CC=C3)OC
InChI=1SC22H25N3O3Sc122(23)19(26)142921242320(1576818(1315)285)25(21)1691117(274)121016h613H14H215H3
MFCD05518486
ZINC000002443995
ZINC02443995
ZINC2443995
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