Vitas-M small molecule compound

methyl {[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate

Catalog ID
STL375381
SMILES CCOc1ccc(cc1)n1c(SCC(=O)OC)nnc1c1ccccc1

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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 C19H19N3O3S MW 369.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O3S/c1-3-25-16-11-9-15(10-12-16)22-18(14-7-5-4-6-8-14)20-21-19(22)26-13-17(23)24-2/h4-12H,3,13H2,1-2H3
InChIKey
BOPAGBUFLMPOGO-UHFFFAOYSA-N
Synonyms
663157-97-9
663157979
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)OC)C3=CC=CC=C3
InChI=1SC19H19N3O3Sc13251611915(101216)2218(147546814)202119(22)261317(23)242h412H313H212H3
methyl((4(4ethoxyphenyl)5phenyl4H124triazol3yl)sulfanyl)acetate
METHYL2((4(4ETHOXYPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)ACETATE
MFCD03998056
ZINC000001144007
ZINC01144007
ZINC1144007

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.