4-[[(4-cyano-3-naphthalen-1-yl-phenyl)-[(3-methylimidazol-4-yl)methyl]amino]methyl]pyridine-2-carbonitrile

Systemtic Name: 4-[[(4-cyano-3-naphthalen-1-yl-phenyl)-[(3-methylimidazol-4-yl)methyl]amino]methyl]pyridine-2-carbonitrile Openeye Name: 4-[[4-cyano-N-[(3-methylimidazol-4-yl)methyl]-3-(1-naphthyl)anilino]methyl]pyridine-2-carbonitrile CAS Name: 4-[[4-cyano-N-[(3-methyl-4-imidazolyl)methyl]-3-(1-naphthalenyl)anilino]methyl]-2-pyridinecarbonitrile IUPAC Name: 4-[[4-cyano-N-[(3-methylimidazol-4-yl)methyl]-3-naphthalen-1-ylanilino]methyl]pyridine-2-carbonitrile Traditional Name: 4-[[4-cyano-N-[(3-methylimidazol-4-yl)methyl]-3-(1-naphthyl)anilino]methyl]picolinonitrile Formula: C29H22N6 MolecularWeight: 454.52518

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CN(CC2=CC(=NC=C2)C#N)C3=CC(=C(C=C3)C#N)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CN1C=NC=C1CN(CC2=CC(=NC=C2)C#N)C3=CC(=C(C=C3)C#N)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H22N6/c1-34-20-32-17-26(34)19-35(18-21-11-12-33-24(13-21)16-31)25-10-9-23(15-30)29(14-25)28-8-4-6-22-5-2-3-7-27(22)28/h2-14,17,20H,18-19H2,1H3