4-phenyl-N-[(E)-1-pyrazin-2-ylethylideneamino]piperazine-1-carbothioamide

Systemtic Name: 4-phenyl-N-[(E)-1-pyrazin-2-ylethylideneamino]piperazine-1-carbothioamide Openeye Name: 4-phenyl-N-[(E)-1-pyrazin-2-ylethylideneamino]piperazine-1-carbothioamide CAS Name: 4-phenyl-N-[(E)-1-(2-pyrazinyl)ethylideneamino]-1-piperazinecarbothioamide IUPAC Name: 4-phenyl-N-[(E)-1-pyrazin-2-ylethylideneamino]piperazine-1-carbothioamide Traditional Name: 4-phenyl-N-[(E)-1-pyrazin-2-ylethylideneamino]piperazine-1-carbothioamide Formula: C17H20N6S MolecularWeight: 340.4459

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N1CCN(CC1)C2=CC=CC=C2)C3=NC=CN=C3

Isomeric SMILES

C/C(=N\NC(=S)N1CCN(CC1)C2=CC=CC=C2)/C3=NC=CN=C3

InChI

InChI=1S/C17H20N6S/c1-14(16-13-18-7-8-19-16)20-21-17(24)23-11-9-22(10-12-23)15-5-3-2-4-6-15/h2-8,13H,9-12H2,1H3,(H,21,24)/b20-14+