(E)-2-[4-(2,2-diphenylethanoyl)piperazin-1-yl]-3-pyridin-3-yl-pent-2-enamide

Systemtic Name: (E)-2-[4-(2,2-diphenylethanoyl)piperazin-1-yl]-3-pyridin-3-yl-pent-2-enamide Openeye Name: (E)-2-[4-(2,2-diphenylacetyl)piperazin-1-yl]-3-(3-pyridyl)pent-2-enamide CAS Name: (E)-2-[4-(1-oxo-2,2-diphenylethyl)-1-piperazinyl]-3-(3-pyridinyl)-2-pentenamide IUPAC Name: (E)-2-[4-(2,2-diphenylacetyl)piperazin-1-yl]-3-pyridin-3-ylpent-2-enamide Traditional Name: (E)-2-[4-(2,2-diphenylacetyl)piperazino]-3-(3-pyridyl)pent-2-enamide Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C(=O)N)N1CCN(CC1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CC/C(=C(/C(=O)N)\N1CCN(CC1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)/C4=CN=CC=C4

InChI

InChI=1S/C28H30N4O2/c1-2-24(23-14-9-15-30-20-23)26(27(29)33)31-16-18-32(19-17-31)28(34)25(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-15,20,25H,2,16-19H2,1H3,(H2,29,33)/b26-24+