Vitas-M small molecule compound
3-(4-chlorophenyl)-5-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Catalog ID
STK230614
SMILES COc1ccc(cc1)OCCSc1nnc(n1C)c1ccc(cc1)Cl
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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 C18H18ClN3O2S MW 375.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O2S/c1-22-17(13-3-5-14(19)6-4-13)20-21-18(22)25-12-11-24-16-9-7-15(23-2)8-10-16/h3-10H,11-12H2,1-2H3InChIKey
XMOIDUVZQWXLLS-UHFFFAOYSA-NSynonyms
3(4CHLOROPHENYL)5((2(4METHOXYPHENOXY)ETHYL)SULFANYL)4METHYL4H124TRIAZOLE
3(4CHLOROPHENYL)5(2(4METHOXYPHENOXY)ETHYLSULFANYL)4METHYL124TRIAZOLE
CN1C(=NN=C1SCCOC2=CC=C(C=C2)OC)C3=CC=C(C=C3)Cl
InChI=1SC18H18ClN3O2Sc12217(133514(19)6413)202118(22)25121124169715(232)81016h310H1112H212H3
MFCD04759204
ZINC000002640635
ZINC02640635
ZINC2640635
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