Vitas-M small molecule compound
1-(3-methoxyphenyl)-2-({4-methyl-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Catalog ID
STK273945
SMILES COc1cccc(c1)C(=O)CSc1nnc(n1C)COc1ccc2c(c1)CCCC2
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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 C23H25N3O3S MW 423.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O3S/c1-26-22(14-29-20-11-10-16-6-3-4-7-17(16)12-20)24-25-23(26)30-15-21(27)18-8-5-9-19(13-18)28-2/h5,8-13H,3-4,6-7,14-15H2,1-2H3InChIKey
DFPCOCWCVGUABX-UHFFFAOYSA-NSynonyms
1(3methoxyphenyl)2((4methyl5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)ethanone
1(3methoxyphenyl)2((4methyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanyl)ethanone
CN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)OC)COC3=CC4=C(CCCC4)C=C3
InChI=1SC23H25N3O3Sc12622(142920111016634717(16)1220)242523(26)301521(27)1885919(1318)282h5813H34671415H212H3
MFCD09268258
ZINC000009614993
ZINC09614993
ZINC9614993
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