Vitas-M small molecule compound
5-(4-ethoxyphenyl)-4-ethyl-2-(9H-xanthen-9-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK736534
SMILES CCOc1ccc(cc1)c1nn(c(=S)n1CC)C1c2ccccc2Oc2c1cccc2
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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 C25H23N3O2S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O2S/c1-3-27-24(17-13-15-18(16-14-17)29-4-2)26-28(25(27)31)23-19-9-5-7-11-21(19)30-22-12-8-6-10-20(22)23/h5-16,23H,3-4H2,1-2H3InChIKey
HODQMGYCRCUIAV-UHFFFAOYSA-NSynonyms
5(4ETHOXYPHENYL)4ETHYL2(9HXANTHEN9YL)124TRIAZOLE3THIONE
5(4ethoxyphenyl)4ethyl2(9Hxanthen9yl)24dihydro3H124triazole3thione
CCN1C(=NN(C1=S)C2C3=CC=CC=C3OC4=CC=CC=C24)C5=CC=C(C=C5)OCC
InChI=1SC25H23N3O2Sc132724(17131518(161417)2942)2628(25(27)31)23199571121(19)302212861020(22)23h51623H34H212H3
MFCD07658451
ZINC000012413654
ZINC12413654
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