N-cyano-4-[2-(1H-imidazol-5-yl)ethanoyl]-N'-(2-methylphenyl)-3-phenyl-piperazine-1-carboximidamide

Systemtic Name: N-cyano-4-[2-(1H-imidazol-5-yl)ethanoyl]-N'-(2-methylphenyl)-3-phenyl-piperazine-1-carboximidamide Openeye Name: N-cyano-4-[2-(1H-imidazol-5-yl)acetyl]-N'-(o-tolyl)-3-phenyl-piperazine-1-carboxamidine CAS Name: N-cyano-4-[2-(1H-imidazol-5-yl)-1-oxoethyl]-N'-(2-methylphenyl)-3-phenyl-1-piperazinecarboximidamide IUPAC Name: N-cyano-4-[2-(1H-imidazol-5-yl)acetyl]-N'-(2-methylphenyl)-3-phenylpiperazine-1-carboximidamide Traditional Name: N-cyano-4-[2-(1H-imidazol-5-yl)acetyl]-N'-(o-tolyl)-3-phenyl-piperazine-1-carboxamidine Formula: C24H25N7O MolecularWeight: 427.5016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N=C(NC#N)N2CCN(C(C2)C3=CC=CC=C3)C(=O)CC4=CN=CN4

Isomeric SMILES

CC1=CC=CC=C1N=C(NC#N)N2CCN(C(C2)C3=CC=CC=C3)C(=O)CC4=CN=CN4

InChI

InChI=1S/C24H25N7O/c1-18-7-5-6-10-21(18)29-24(27-16-25)30-11-12-31(23(32)13-20-14-26-17-28-20)22(15-30)19-8-3-2-4-9-19/h2-10,14,17,22H,11-13,15H2,1H3,(H,26,28)(H,27,29)