4-[azanyl-(3-methylimidazol-4-yl)-(7-phenyl-5-pyridin-3-yl-1-benzofuran-2-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[azanyl-(3-methylimidazol-4-yl)-(7-phenyl-5-pyridin-3-yl-1-benzofuran-2-yl)methyl]benzenecarbonitrile Openeye Name: 4-[amino-(3-methylimidazol-4-yl)-[7-phenyl-5-(3-pyridyl)benzofuran-2-yl]methyl]benzonitrile CAS Name: 4-[amino-(3-methyl-4-imidazolyl)-[7-phenyl-5-(3-pyridinyl)-2-benzofuranyl]methyl]benzonitrile IUPAC Name: 4-[amino-(3-methylimidazol-4-yl)-(7-phenyl-5-pyridin-3-yl-1-benzofuran-2-yl)methyl]benzonitrile Traditional Name: 4-[amino-(3-methylimidazol-4-yl)-[7-phenyl-5-(3-pyridyl)benzofuran-2-yl]methyl]benzonitrile Formula: C31H23N5O MolecularWeight: 481.54722

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)(C3=CC4=CC(=CC(=C4O3)C5=CC=CC=C5)C6=CN=CC=C6)N

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)(C3=CC4=CC(=CC(=C4O3)C5=CC=CC=C5)C6=CN=CC=C6)N

InChI

InChI=1S/C31H23N5O/c1-36-20-35-19-28(36)31(33,26-11-9-21(17-32)10-12-26)29-16-25-14-24(23-8-5-13-34-18-23)15-27(30(25)37-29)22-6-3-2-4-7-22/h2-16,18-20H,33H2,1H3