Vitas-M small molecule compound

propan-2-yl [(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate

Catalog ID
STL050830
SMILES CC(OC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1)C

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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 C19H19N3O2S MW 353.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O2S/c1-14(2)24-17(23)13-25-19-21-20-18(15-9-5-3-6-10-15)22(19)16-11-7-4-8-12-16/h3-12,14H,13H2,1-2H3
InChIKey
SLYUYCCCUIXNGG-UHFFFAOYSA-N
Synonyms
849009-18-3
849009183
CC(C)OC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3
InChI=1SC19H19N3O2Sc114(2)2417(23)132519212018(1595361015)22(19)16117481216h31214H13H212H3
isopropyl2((45diphenyl4H124triazol3yl)thio)acetate
MFCD05680484
propan2yl((45diphenyl4H124triazol3yl)sulfanyl)acetate
PROPAN2YL2((45DIPHENYL124TRIAZOL3YL)SULFANYL)ACETATE
ZINC000002450988
ZINC02450988
ZINC2450988

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Available files

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