Vitas-M small molecule compound
1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-({4-(prop-2-en-1-yl)-5-[(quinolin-8-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Catalog ID
STK807753
SMILES C=CCn1c(SCC(=O)c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)nnc1COc1cccc2c1nccc2
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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 C31H36N4O3S MW 544.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N4O3S/c1-8-15-35-26(18-38-25-13-9-11-20-12-10-14-32-27(20)25)33-34-29(35)39-19-24(36)21-16-22(30(2,3)4)28(37)23(17-21)31(5,6)7/h8-14,16-17,37H,1,15,18-19H2,2-7H3InChIKey
ZZVCOASZHUJBLK-UHFFFAOYSA-NSynonyms
690249-79-71(35BIS(TERTBUTYL)4HYDROXYPHENYL)2(4PROP2ENYL5(8QUINOLYLOXYMETHYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
1(35ditertbutyl4hydroxyphenyl)2((4(prop2en1yl)5((quinolin8yloxy)methyl)4H124triazol3yl)sulfanyl)ethanone
1(35DITERTBUTYL4HYDROXYPHENYL)2((4PROP2ENYL5(QUINOLIN8YLOXYMETHYL)124TRIAZOL3YL)SULFANYL)ETHANONE
2((4ALLYL5((QUINOLIN8YLOXY)METHYL)4H124TRIAZOL3YL)THIO)1(35DITERTBUTYL4HYDROXYPHENYL)ETHANONE
690249797
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CSC2=NN=C(N2CC=C)COC3=CC=CC4=C3N=CC=C4
InChI=1SC31H36N4O3Sc18153526(18382513911201210143227(20)25)333429(35)391924(36)211622(30(23)4)28(37)23(1721)31(56)7h814161737H1151819H227H3
MFCD05865821
ZINC000002709023
ZINC2709023
Check stock
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Check stock on Vitas-MAvailable files
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