Vitas-M small molecule compound
3-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Catalog ID
STK734357
SMILES COc1ccc(cc1)c1nnc(n1c1ccccc1)SCc1ccc2c(c1)OCO2
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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 C23H19N3O3S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O3S/c1-27-19-10-8-17(9-11-19)22-24-25-23(26(22)18-5-3-2-4-6-18)30-14-16-7-12-20-21(13-16)29-15-28-20/h2-13H,14-15H2,1H3InChIKey
WMPONWKJAONPFU-UHFFFAOYSA-NSynonyms
3((13benzodioxol5ylmethyl)sulfanyl)5(4methoxyphenyl)4phenyl4H124triazole
3(13BENZODIOXOL5YLMETHYLSULFANYL)5(4METHOXYPHENYL)4PHENYL124TRIAZOLE
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=CC5=C(C=C4)OCO5
InChI=1SC23H19N3O3Sc1271910817(91119)22242523(26(22)185324618)3014167122021(1316)29152820h213H1415H21H3
MFCD01418215
ZINC000001062736
ZINC01062736
ZINC1062736
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