4-[4-(1-methylimidazol-4-yl)-3-oxidanylidene-but-1-ynyl]-N'-(4-methylsulfanyl-1-oxidanylidene-butan-2-yl)-2-phenyl-benzohydrazide

Systemtic Name: 4-[4-(1-methylimidazol-4-yl)-3-oxidanylidene-but-1-ynyl]-N'-(4-methylsulfanyl-1-oxidanylidene-butan-2-yl)-2-phenyl-benzohydrazide Openeye Name: N'-(1-formyl-3-methylsulfanyl-propyl)-4-[4-(1-methylimidazol-4-yl)-3-oxo-but-1-ynyl]-2-phenyl-benzohydrazide CAS Name: 4-[4-(1-methyl-4-imidazolyl)-3-oxobut-1-ynyl]-N'-[4-(methylthio)-1-oxobutan-2-yl]-2-phenylbenzohydrazide IUPAC Name: 4-[4-(1-methylimidazol-4-yl)-3-oxobut-1-ynyl]-N'-(4-methylsulfanyl-1-oxobutan-2-yl)-2-phenylbenzohydrazide Traditional Name: N'-[1-formyl-3-(methylthio)propyl]-4-[3-keto-4-(1-methylimidazol-4-yl)but-1-ynyl]-2-phenyl-benzohydrazide Formula: C26H26N4O3S MolecularWeight: 474.57464

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)CC(=O)C#CC2=CC(=C(C=C2)C(=O)NNC(CCSC)C=O)C3=CC=CC=C3

Isomeric SMILES

CN1C=C(N=C1)CC(=O)C#CC2=CC(=C(C=C2)C(=O)NNC(CCSC)C=O)C3=CC=CC=C3

InChI

InChI=1S/C26H26N4O3S/c1-30-16-22(27-18-30)15-23(32)10-8-19-9-11-24(25(14-19)20-6-4-3-5-7-20)26(33)29-28-21(17-31)12-13-34-2/h3-7,9,11,14,16-18,21,28H,12-13,15H2,1-2H3,(H,29,33)