N-ethyl-2-[(4-methylpentanoylamino)-phenyl-amino]-N'-oxidanyl-2-[(E)-3-phenylprop-2-enyl]propanediamide

Systemtic Name: N-ethyl-2-[(4-methylpentanoylamino)-phenyl-amino]-N'-oxidanyl-2-[(E)-3-phenylprop-2-enyl]propanediamide Openeye Name: (E)-N-ethyl-2-(hydroxycarbamoyl)-2-(N-(4-methylpentanoylamino)anilino)-5-phenyl-pent-4-enamide CAS Name: N-ethyl-N'-hydroxy-2-(N-[(4-methyl-1-oxopentyl)amino]anilino)-2-[(E)-3-phenylprop-2-enyl]propanediamide IUPAC Name: N-ethyl-N'-hydroxy-2-(N-(4-methylpentanoylamino)anilino)-2-[(E)-3-phenylprop-2-enyl]propanediamide Traditional Name: (E)-N-ethyl-2-(hydroxycarbamoyl)-2-(N-(4-methylpentanoylamino)anilino)-5-phenyl-pent-4-enamide Formula: C26H34N4O4 MolecularWeight: 466.57256

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(CC=CC1=CC=CC=C1)(C(=O)NO)N(C2=CC=CC=C2)NC(=O)CCC(C)C

Isomeric SMILES

CCNC(=O)C(C/C=C/C1=CC=CC=C1)(C(=O)NO)N(C2=CC=CC=C2)NC(=O)CCC(C)C

InChI

InChI=1S/C26H34N4O4/c1-4-27-24(32)26(25(33)29-34,19-11-14-21-12-7-5-8-13-21)30(22-15-9-6-10-16-22)28-23(31)18-17-20(2)3/h5-16,20,34H,4,17-19H2,1-3H3,(H,27,32)(H,28,31)(H,29,33)/b14-11+