3-[4-(4-imidazol-1-ylphenyl)carbonylpiperazin-1-yl]benzenecarboximidamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(=N)N)C(=O)C3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(=N)N)C(=O)C3=CC=C(C=C3)N4C=CN=C4

InChI

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