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

Systemtic Name: (2E)-2-[[4-[4-(2-phenylphenyl)piperazin-1-yl]pyridin-3-yl]methylidene]hexanamide Openeye Name: (2E)-2-[[4-[4-(2-phenylphenyl)piperazin-1-yl]-3-pyridyl]methylene]hexanamide CAS Name: (2E)-2-[[4-[4-(2-phenylphenyl)-1-piperazinyl]-3-pyridinyl]methylidene]hexanamide IUPAC Name: (2E)-2-[[4-[4-(2-phenylphenyl)piperazin-1-yl]pyridin-3-yl]methylidene]hexanamide Traditional Name: (E)-2-butyl-3-[4-[4-(2-phenylphenyl)piperazino]-3-pyridyl]acrylamide Formula: C28H32N4O MolecularWeight: 440.57988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC1=C(C=CN=C1)N2CCN(CC2)C3=CC=CC=C3C4=CC=CC=C4)C(=O)N

Isomeric SMILES

CCCC/C(=C\C1=C(C=CN=C1)N2CCN(CC2)C3=CC=CC=C3C4=CC=CC=C4)/C(=O)N

InChI

InChI=1S/C28H32N4O/c1-2-3-9-23(28(29)33)20-24-21-30-15-14-26(24)31-16-18-32(19-17-31)27-13-8-7-12-25(27)22-10-5-4-6-11-22/h4-8,10-15,20-21H,2-3,9,16-19H2,1H3,(H2,29,33)/b23-20+