Vitas-M small molecule compound
N'-[(E)-(4-ethoxyphenyl)methylidene]-2-[(5-{[(4-methylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanehydrazide
Catalog ID
STL172068
SMILES CCOc1ccc(cc1)/C=N/NC(=O)C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1)C)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 C28H30N6O2S MW 514.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N6O2S/c1-4-36-25-16-12-22(13-17-25)18-30-32-27(35)21(3)37-28-33-31-26(34(28)24-8-6-5-7-9-24)19-29-23-14-10-20(2)11-15-23/h5-18,21,29H,4,19H2,1-3H3,(H,32,35)/b30-18+InChIKey
JMUFABLDLKVOBG-UXHLAJHPSA-NSynonyms
CCOC1=CC=C(C=C1)C=NNC(=O)C(C)SC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=C(C=C4)C
CCOc1ccc(cc1)C=NNC(=O)C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1)C)C
InChI=1SC28H30N6O2Sc143625161222(131725)18303227(35)21(3)3728333126(34(28)248657924)192923141020(2)111523h5182129H419H213H3(H3235)b3018+
MFCD01432188
N((E)(4ethoxyphenyl)methylidene)2((5(((4methylphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)propanehydrazide
N((E)(4ethoxyphenyl)methylideneamino)2((5((4methylanilino)methyl)4phenyl124triazol3yl)sulfanyl)propanamide
ZINC000002097406
ZINC000002097411
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