Vitas-M small molecule compound
methyl {[5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Catalog ID
STL481198
SMILES COC(=O)CSc1nnc([nH]1)c1ccccc1OC
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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 C12H13N3O3S MW 279.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3O3S/c1-17-9-6-4-3-5-8(9)11-13-12(15-14-11)19-7-10(16)18-2/h3-6H,7H2,1-2H3,(H,13,14,15)InChIKey
TXWSLDPLMMJZMH-UHFFFAOYSA-NSynonyms
COC(=O)CSc1nnc((nH)1)c1ccccc1OC
COC1=CC=CC=C1C2=NC(=NN2)SCC(=O)OC
InChI=1SC12H13N3O3Sc117964358(9)111312(151411)19710(16)182h36H7H212H3(H131415)
methyl((5(2methoxyphenyl)4H124triazol3yl)sulfanyl)acetate
METHYL2((5(2METHOXYPHENYL)1H124TRIAZOL3YL)SULFANYL)ACETATE
MFCD08068323
ZINC000006701435
ZINC06701435
ZINC6701435
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