Vitas-M small molecule compound

2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(3-methoxyphenyl)ethylidene]acetohydrazide

Catalog ID
STL362655
SMILES COc1cccc(c1)/C(=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)Br)/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 C25H22BrN5O2S MW 536.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN5O2S/c1-17(19-7-6-10-22(15-19)33-2)27-28-23(32)16-34-25-30-29-24(18-11-13-20(26)14-12-18)31(25)21-8-4-3-5-9-21/h3-15H,16H2,1-2H3,(H,28,32)/b27-17+
InChIKey
CZVSAEYACISAEG-WPWMEQJKSA-N
Synonyms
315182-20-8
(E)2((5(4bromophenyl)4phenyl4H124triazol3yl)thio)N(1(3methoxyphenyl)ethylidene)acetohydrazide
2((5(4bromophenyl)4phenyl124triazol3yl)sulfanyl)N((E)1(3methoxyphenyl)ethylideneamino)acetamide
2((5(4bromophenyl)4phenyl4H124triazol3yl)sulfanyl)N((1E)1(3methoxyphenyl)ethylidene)acetohydrazide
315182208
CC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)Br)C4=CC(=CC=C4)OC
COc1cccc(c1)C(=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)Br)C
InChI=1SC25H22BrN5O2Sc117(19761022(1519)332)272823(32)163425302924(18111320(26)141218)31(25)218435921h315H16H212H3(H2832)b2717+
MFCD02074954
N((1E)2(3METHOXYPHENYL)1AZAPROP1ENYL)2(5(4BROMOPHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000004530767
ZINC103441848

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Available files

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