4-[[[(E)-3-(4-methylsulfanylphenyl)-2-pyridin-3-yl-prop-2-enoyl]amino]methyl]-N-oxidanyl-benzamide

Systemtic Name: 4-[[[(E)-3-(4-methylsulfanylphenyl)-2-pyridin-3-yl-prop-2-enoyl]amino]methyl]-N-oxidanyl-benzamide Openeye Name: (E)-N-[[4-(hydroxycarbamoyl)phenyl]methyl]-3-(4-methylsulfanylphenyl)-2-(3-pyridyl)prop-2-enamide CAS Name: N-hydroxy-4-[[[(E)-3-[4-(methylthio)phenyl]-1-oxo-2-(3-pyridinyl)prop-2-enyl]amino]methyl]benzamide IUPAC Name: N-hydroxy-4-[[[(E)-3-(4-methylsulfanylphenyl)-2-pyridin-3-ylprop-2-enoyl]amino]methyl]benzamide Traditional Name: (E)-N-[4-(hydroxycarbamoyl)benzyl]-3-[4-(methylthio)phenyl]-2-(3-pyridyl)acrylamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C(C2=CN=CC=C2)C(=O)NCC3=CC=C(C=C3)C(=O)NO

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C(\C2=CN=CC=C2)/C(=O)NCC3=CC=C(C=C3)C(=O)NO

InChI

InChI=1S/C23H21N3O3S/c1-30-20-10-6-16(7-11-20)13-21(19-3-2-12-24-15-19)23(28)25-14-17-4-8-18(9-5-17)22(27)26-29/h2-13,15,29H,14H2,1H3,(H,25,28)(H,26,27)/b21-13+