Vitas-M small molecule compound
methyl ({5-[(4-tert-butylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Catalog ID
STK470246
SMILES COC(=O)CSc1nnc(n1CC)COc1ccc(cc1)C(C)(C)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 C18H25N3O3S MW 363.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3O3S/c1-6-21-15(19-20-17(21)25-12-16(22)23-5)11-24-14-9-7-13(8-10-14)18(2,3)4/h7-10H,6,11-12H2,1-5H3InChIKey
BKNZBSPBDKGFKO-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)OC)COC2=CC=C(C=C2)C(C)(C)C
InChI=1SC18H25N3O3Sc162115(192017(21)251216(22)235)1124149713(81014)18(23)4h710H61112H215H3
methyl((5((4tertbutylphenoxy)methyl)4ethyl4H124triazol3yl)sulfanyl)acetate
methyl2((5((4tertbutylphenoxy)methyl)4ethyl124triazol3yl)sulfanyl)acetate
METHYL2(5((4(TERTBUTYL)PHENOXY)METHYL)4ETHYL124TRIAZOL3YLTHIO)ACETATE
MFCD06155508
ZINC000017074794
ZINC17074794
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