(2E)-2-[[5-[4-(diphenylmethyl)piperazin-1-yl]pyridin-3-yl]methylidene]heptanamide

Systemtic Name: (2E)-2-[[5-[4-(diphenylmethyl)piperazin-1-yl]pyridin-3-yl]methylidene]heptanamide Openeye Name: (2E)-2-[[5-(4-benzhydrylpiperazin-1-yl)-3-pyridyl]methylene]heptanamide CAS Name: (2E)-2-[[5-[4-(diphenylmethyl)-1-piperazinyl]-3-pyridinyl]methylidene]heptanamide IUPAC Name: (2E)-2-[[5-(4-benzhydrylpiperazin-1-yl)pyridin-3-yl]methylidene]heptanamide Traditional Name: (E)-2-amyl-3-[5-(4-benzhydrylpiperazino)-3-pyridyl]acrylamide Formula: C30H36N4O MolecularWeight: 468.63304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H36N4O/c1-2-3-6-15-27(30(31)35)20-24-21-28(23-32-22-24)33-16-18-34(19-17-33)29(25-11-7-4-8-12-25)26-13-9-5-10-14-26/h4-5,7-14,20-23,29H,2-3,6,15-19H2,1H3,(H2,31,35)/b27-20+