Vitas-M small molecule compound
2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STL307999
SMILES COc1cc(OC)cc(c1/C=N/NC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)C)OC
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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 C27H33N5O4S MW 523.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N5O4S/c1-18-10-12-19(13-11-18)26-30-31-27(32(26)20-8-6-5-7-9-20)37-17-25(33)29-28-16-22-23(35-3)14-21(34-2)15-24(22)36-4/h10-16,20H,5-9,17H2,1-4H3,(H,29,33)/b28-16+InChIKey
SCJUATYQWTYOIL-LQKURTRISA-NSynonyms
497169-86-5(E)2((4cyclohexyl5(ptolyl)4H124triazol3yl)thio)N(246trimethoxybenzylidene)acetohydrazide
2((4CYCLOHEXYL5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(246TRIMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4cyclohexyl5(4methylphenyl)4H124triazol3yl)sulfanyl)N((E)(246trimethoxyphenyl)methylidene)acetohydrazide
497169865
CC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC(=O)NN=CC4=C(C=C(C=C4OC)OC)OC
InChI=1SC27H33N5O4Sc118101219(131118)26303127(32(26)208657920)371725(33)2928162223(353)1421(342)1524(22)364h101620H5917H214H3(H2933)b2816+
MFCD03222521
N((1E)2(246TRIMETHOXYPHENYL)1AZAVINYL)2(4CYCLOHEXYL5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009122278
ZINC33735702
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