Vitas-M small molecule compound
2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-phenoxyphenyl)methylidene]acetohydrazide
Catalog ID
STL337691
SMILES O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)C)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 C30H31N5O2S MW 525.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N5O2S/c1-22-15-17-24(18-16-22)29-33-34-30(35(29)25-10-4-2-5-11-25)38-21-28(36)32-31-20-23-9-8-14-27(19-23)37-26-12-6-3-7-13-26/h3,6-9,12-20,25H,2,4-5,10-11,21H2,1H3,(H,32,36)/b31-20+InChIKey
DVZBGANCFUSNDT-AJBULDERSA-NSynonyms
612826-23-0(E)2((4cyclohexyl5(ptolyl)4H124triazol3yl)thio)N(3phenoxybenzylidene)acetohydrazide
2((4cyclohexyl5(4methylphenyl)124triazol3yl)sulfanyl)N((E)(3phenoxyphenyl)methylideneamino)acetamide
2((4cyclohexyl5(4methylphenyl)4H124triazol3yl)sulfanyl)N((E)(3phenoxyphenyl)methylidene)acetohydrazide
612826230
CC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC(=O)NN=CC4=CC(=CC=C4)OC5=CC=CC=C5
InChI=1SC30H31N5O2Sc122151724(181622)29333430(35(29)25104251125)382128(36)32312023981427(1923)3726126371326h369122025H245101121H21H3(H3236)b3120+
MFCD03222452
N((1E)2(3PHENOXYPHENYL)1AZAVINYL)2(4CYCLOHEXYL5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009428045
ZINC33735238
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