5-(1-azabicyclo[3.2.1]octan-2-yl)-6-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-pyrazin-2-one

Systemtic Name: 5-(1-azabicyclo[3.2.1]octan-2-yl)-6-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-pyrazin-2-one Openeye Name: 5-(1-azabicyclo[3.2.1]octan-2-yl)-6-[(E)-cinnamyl]sulfanyl-1H-pyrazin-2-one CAS Name: 5-(1-azabicyclo[3.2.1]octan-2-yl)-6-[[(E)-3-phenylprop-2-enyl]thio]-1H-pyrazin-2-one IUPAC Name: 5-(1-azabicyclo[3.2.1]octan-2-yl)-6-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-pyrazin-2-one Traditional Name: 5-(1-azabicyclo[3.2.1]octan-2-yl)-6-[[(E)-cinnamyl]thio]-1H-pyrazin-2-one Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N2CCC1C2)C3=C(NC(=O)C=N3)SCC=CC4=CC=CC=C4

Isomeric SMILES

C1CC(N2CCC1C2)C3=C(NC(=O)C=N3)SC/C=C/C4=CC=CC=C4

InChI

InChI=1S/C20H23N3OS/c24-18-13-21-19(17-9-8-16-10-11-23(17)14-16)20(22-18)25-12-4-7-15-5-2-1-3-6-15/h1-7,13,16-17H,8-12,14H2,(H,22,24)/b7-4+