Vitas-M small molecule compound

N'-[(Z)-(5-bromo-2-methoxyphenyl)methylidene]-2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STK110580
SMILES COc1ccc(cc1/C=N\NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)Br

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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 C29H30BrN5O2S MW 592.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30BrN5O2S/c1-19-6-13-24(14-7-19)35-27(20-8-10-22(11-9-20)29(2,3)4)33-34-28(35)38-18-26(36)32-31-17-21-16-23(30)12-15-25(21)37-5/h6-17H,18H2,1-5H3,(H,32,36)/b31-17-
InChIKey
XPLUEOXCNRKBJS-LJUMEUDFSA-N
Synonyms

(E)N(5bromo2methoxybenzylidene)2((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)acetohydrazide
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=C(C=CC(=C3)Br)OC)C4=CC=C(C=C4)C(C)(C)C
COc1ccc(cc1C=NNC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)Br
InChI=1SC29H30BrN5O2Sc11961324(14719)3527(2081022(11920)29(23)4)333428(35)381826(36)323117211623(30)121525(21)375h617H18H215H3(H3236)b3117
MFCD03219983
N((1Z)2(5BROMO2METHOXYPHENYL)1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N((Z)(5BROMO2METHOXYPHENYL)METHYLIDENE)2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
N((Z)(5BROMO2METHOXYPHENYL)METHYLIDENEAMINO)2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000100852151
ZINC01850784
ZINC1850784

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Available files

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