Vitas-M small molecule compound
ethyl 4-({[5-(2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzoate
Catalog ID
STL297340
SMILES C=CCn1c(SCc2ccc(cc2)C(=O)OCC)nnc1c1ccccc1O
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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 C21H21N3O3S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S/c1-3-13-24-19(17-7-5-6-8-18(17)25)22-23-21(24)28-14-15-9-11-16(12-10-15)20(26)27-4-2/h3,5-12,25H,1,4,13-14H2,2H3InChIKey
BGDUEBPJLVPAGW-UHFFFAOYSA-NSynonyms
824420-01-1824420011
ethyl4(((5(2hydroxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)methyl)benzoate
MFCD06621171
ZINC000005060374
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