N-(6-chloranyl-2-phenyl-pyrimidin-4-yl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(6-chloranyl-2-phenyl-pyrimidin-4-yl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanamide Openeye Name: N-(6-chloro-2-phenyl-pyrimidin-4-yl)-2-[4-[(E)-cinnamyl]piperazin-1-yl]acetamide CAS Name: N-(6-chloro-2-phenyl-4-pyrimidinyl)-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]acetamide IUPAC Name: N-(6-chloro-2-phenylpyrimidin-4-yl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]acetamide Traditional Name: N-(6-chloro-2-phenyl-pyrimidin-4-yl)-2-[4-[(E)-cinnamyl]piperazino]acetamide Formula: C25H26ClN5O MolecularWeight: 447.95984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)CC(=O)NC3=CC(=NC(=N3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)CC(=O)NC3=CC(=NC(=N3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H26ClN5O/c26-22-18-23(29-25(27-22)21-11-5-2-6-12-21)28-24(32)19-31-16-14-30(15-17-31)13-7-10-20-8-3-1-4-9-20/h1-12,18H,13-17,19H2,(H,27,28,29,32)/b10-7+