(2E)-2-[[4-[4-(phenylcarbonyl)piperazin-1-yl]pyridin-3-yl]methylidene]hexanamide

Systemtic Name: (2E)-2-[[4-[4-(phenylcarbonyl)piperazin-1-yl]pyridin-3-yl]methylidene]hexanamide Openeye Name: (2E)-2-[[4-(4-benzoylpiperazin-1-yl)-3-pyridyl]methylene]hexanamide CAS Name: (2E)-2-[[4-(4-benzoyl-1-piperazinyl)-3-pyridinyl]methylidene]hexanamide IUPAC Name: (2E)-2-[[4-(4-benzoylpiperazin-1-yl)pyridin-3-yl]methylidene]hexanamide Traditional Name: (E)-3-[4-(4-benzoylpiperazino)-3-pyridyl]-2-butyl-acrylamide Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC1=C(C=CN=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CCCC/C(=C\C1=C(C=CN=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)/C(=O)N

InChI

InChI=1S/C23H28N4O2/c1-2-3-7-19(22(24)28)16-20-17-25-11-10-21(20)26-12-14-27(15-13-26)23(29)18-8-5-4-6-9-18/h4-6,8-11,16-17H,2-3,7,12-15H2,1H3,(H2,24,28)/b19-16+