Vitas-M small molecule compound

1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-{[4-phenyl-5-(phenylamino)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STL323600
SMILES O=C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)CSc1nnc(n1c1ccccc1)Nc1ccccc1

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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 C30H34N4O2S MW 514.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O2S/c1-29(2,3)23-17-20(18-24(26(23)36)30(4,5)6)25(35)19-37-28-33-32-27(31-21-13-9-7-10-14-21)34(28)22-15-11-8-12-16-22/h7-18,36H,19H2,1-6H3,(H,31,32)
InChIKey
XTDGCPSZLVLWDJ-UHFFFAOYSA-N
Synonyms
143212-98-0
1(35BIS(TERTBUTYL)4HYDROXYPHENYL)2(4PHENYL5(PHENYLAMINO)(124TRIAZOL3YLTHIO))ETHAN1ONE
1(35DITERTBUTYL4HYDROXYPHENYL)2((4PHENYL5(PHENYLAMINO)4H124TRIAZOL3YL)SULFANYL)ETHAN1ONE
1(35ditertbutyl4hydroxyphenyl)2((4phenyl5(phenylamino)4H124triazol3yl)sulfanyl)ethanone
1(35ditertbutyl4hydroxyphenyl)2((4phenyl5(phenylamino)4H124triazol3yl)thio)ethanone
143212980
2((5ANILINO4PHENYL124TRIAZOL3YL)SULFANYL)1(35DITERTBUTYL4HYDROXYPHENYL)ETHANONE
2((5ANILINO4PHENYL4H124TRIAZOL3YL)THIO)1(35DI(TERTBUTYL)4HYDROXYPHENYL)ETHAN1ONE
3((2(35DITERTBUTYL4HYDROXYPHENYL)2OXOETHYL)THIO)4PHENYL5(PHENYLAMINO)4H124TRIAZOLE
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)NC4=CC=CC=C4
InChI=1SC30H34N4O2Sc129(23)231720(1824(26(23)36)30(45)6)25(35)193728333227(31211397101421)34(28)2215118121622h71836H19H216H3(H3132)
MFCD00182700
ZINC000002314755
ZINC02314755
ZINC2314755

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Available files

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