Vitas-M small molecule compound
4-methoxybenzyl [(1-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetate
Catalog ID
STK728694
SMILES COc1ccc(cc1)COC(=O)CSc1ncn(n1)c1ccccc1
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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 C18H17N3O3S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S/c1-23-16-9-7-14(8-10-16)11-24-17(22)12-25-18-19-13-21(20-18)15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3InChIKey
JPQWBCLAVICQGP-UHFFFAOYSA-NSynonyms
881225-67-8(4METHOXYPHENYL)METHYL2((1PHENYL124TRIAZOL3YL)SULFANYL)ACETATE
4methoxybenzyl((1phenyl1H124triazol3yl)sulfanyl)acetate
4methoxybenzyl2((1phenyl1H124triazol3yl)thio)acetate
881225678
COC1=CC=C(C=C1)COC(=O)CSC2=NN(C=N2)C3=CC=CC=C3
InChI=1SC18H17N3O3Sc123169714(81016)112417(22)122518191321(2018)155324615h21013H1112H21H3
MFCD06760514
ZINC000005204690
ZINC05204690
ZINC5204690
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