3-[4-[4-(1H-imidazol-5-yl)phenyl]carbonylpiperazin-1-yl]benzenecarboximidamide

Systemtic Name: 3-[4-[4-(1H-imidazol-5-yl)phenyl]carbonylpiperazin-1-yl]benzenecarboximidamide Openeye Name: 3-[4-[4-(1H-imidazol-5-yl)benzoyl]piperazin-1-yl]benzamidine CAS Name: 3-[4-[[4-(1H-imidazol-5-yl)phenyl]-oxomethyl]-1-piperazinyl]benzenecarboximidamide IUPAC Name: 3-[4-[4-(1H-imidazol-5-yl)benzoyl]piperazin-1-yl]benzenecarboximidamide Traditional Name: 3-[4-[4-(1H-imidazol-5-yl)benzoyl]piperazino]benzamidine Formula: C21H22N6O MolecularWeight: 374.43898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(=N)N)C(=O)C3=CC=C(C=C3)C4=CN=CN4

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(=N)N)C(=O)C3=CC=C(C=C3)C4=CN=CN4

InChI

InChI=1S/C21H22N6O/c22-20(23)17-2-1-3-18(12-17)26-8-10-27(11-9-26)21(28)16-6-4-15(5-7-16)19-13-24-14-25-19/h1-7,12-14H,8-11H2,(H3,22,23)(H,24,25)