Vitas-M small molecule compound
N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STL337308
SMILES O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)C)N/N=C/c1cccc(c1)OCc1ccccc1
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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 C31H33N5O2S MW 539.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N5O2S/c1-23-15-17-26(18-16-23)30-34-35-31(36(30)27-12-6-3-7-13-27)39-22-29(37)33-32-20-25-11-8-14-28(19-25)38-21-24-9-4-2-5-10-24/h2,4-5,8-11,14-20,27H,3,6-7,12-13,21-22H2,1H3,(H,33,37)/b32-20+InChIKey
IUKOXTKVUQDNID-UZWMFBFFSA-NSynonyms
612826-11-6(E)N(3(benzyloxy)benzylidene)2((4cyclohexyl5(ptolyl)4H124triazol3yl)thio)acetohydrazide
2((4cyclohexyl5(4methylphenyl)124triazol3yl)sulfanyl)N((E)(3phenylmethoxyphenyl)methylideneamino)acetamide
612826116
CC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC(=O)NN=CC4=CC(=CC=C4)OCC5=CC=CC=C5
InChI=1SC31H33N5O2Sc123151726(181623)30343531(36(30)27126371327)392229(37)333220251181428(1925)38212494251024h245811142027H36712132122H21H3(H3337)b3220+
MFCD03217643
N((1E)2(3(PHENYLMETHOXY)PHENYL)1AZAVINYL)2(4CYCLOHEXYL5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)(3(benzyloxy)phenyl)methylidene)2((4cyclohexyl5(4methylphenyl)4H124triazol3yl)sulfanyl)acetohydrazide
ZINC000100858938
ZINC101420551
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