Vitas-M small molecule compound
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-phenoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK791418
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)Br)N/N=C/c1cccc(c1)Oc1ccccc1
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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 C29H22BrN5O2S MW 584.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22BrN5O2S/c30-23-16-14-22(15-17-23)28-33-34-29(35(28)24-9-3-1-4-10-24)38-20-27(36)32-31-19-21-8-7-13-26(18-21)37-25-11-5-2-6-12-25/h1-19H,20H2,(H,32,36)/b31-19+InChIKey
LVCACMMLZKLKOR-ZCTHSVRISA-NSynonyms
303103-55-1(E)2((5(4bromophenyl)4phenyl4H124triazol3yl)thio)N(3phenoxybenzylidene)acetohydrazide
2((5(4BROMOPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)(3PHENOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4bromophenyl)4phenyl4H124triazol3yl)sulfanyl)N((E)(3phenoxyphenyl)methylidene)acetohydrazide
303103551
C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC(=CC=C3)OC4=CC=CC=C4)C5=CC=C(C=C5)Br
InChI=1SC29H22BrN5O2Sc3023161422(151723)28333429(35(28)2493141024)382027(36)32311921871326(1821)3725115261225h119H20H2(H3236)b3119+
MFCD02074911
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)Br)NN=Cc1cccc(c1)Oc1ccccc1
ZINC000001891706
ZINC102809789
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