N-cyano-N'-(2-methylphenyl)-4-(2-naphthalen-2-ylethanoyl)-3-phenyl-piperazine-1-carboximidamide

Systemtic Name: N-cyano-N'-(2-methylphenyl)-4-(2-naphthalen-2-ylethanoyl)-3-phenyl-piperazine-1-carboximidamide Openeye Name: N-cyano-4-[2-(2-naphthyl)acetyl]-N'-(o-tolyl)-3-phenyl-piperazine-1-carboxamidine CAS Name: N-cyano-N'-(2-methylphenyl)-4-[2-(2-naphthalenyl)-1-oxoethyl]-3-phenyl-1-piperazinecarboximidamide IUPAC Name: N-cyano-N'-(2-methylphenyl)-4-(2-naphthalen-2-ylacetyl)-3-phenylpiperazine-1-carboximidamide Traditional Name: N-cyano-4-[2-(2-naphthyl)acetyl]-N'-(o-tolyl)-3-phenyl-piperazine-1-carboxamidine Formula: C31H29N5O MolecularWeight: 487.59486

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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=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC=CC=C1N=C(NC#N)N2CCN(C(C2)C3=CC=CC=C3)C(=O)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H29N5O/c1-23-9-5-8-14-28(23)34-31(33-22-32)35-17-18-36(29(21-35)26-11-3-2-4-12-26)30(37)20-24-15-16-25-10-6-7-13-27(25)19-24/h2-16,19,29H,17-18,20-21H2,1H3,(H,33,34)