6-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-7H-purine

Systemtic Name: 6-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-7H-purine Openeye Name: 6-[4-[(E)-cinnamyl]piperazin-1-yl]-7H-purine CAS Name: 6-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-7H-purine IUPAC Name: 6-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-7H-purine Traditional Name: 6-[4-[(E)-cinnamyl]piperazino]-7H-purine Formula: C18H20N6 MolecularWeight: 320.3916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C3=NC=NC4=C3NC=N4

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C18H20N6/c1-2-5-15(6-3-1)7-4-8-23-9-11-24(12-10-23)18-16-17(20-13-19-16)21-14-22-18/h1-7,13-14H,8-12H2,(H,19,20,21,22)/b7-4+