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

Systemtic Name: 4-[azanyl-[7-(3-chlorophenyl)-5-pyridin-3-yl-1-benzofuran-2-yl]-(3-methylimidazol-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[amino-[7-(3-chlorophenyl)-5-(3-pyridyl)benzofuran-2-yl]-(3-methylimidazol-4-yl)methyl]benzonitrile CAS Name: 4-[amino-[7-(3-chlorophenyl)-5-(3-pyridinyl)-2-benzofuranyl]-(3-methyl-4-imidazolyl)methyl]benzonitrile IUPAC Name: 4-[amino-[7-(3-chlorophenyl)-5-pyridin-3-yl-1-benzofuran-2-yl]-(3-methylimidazol-4-yl)methyl]benzonitrile Traditional Name: 4-[amino-[7-(3-chlorophenyl)-5-(3-pyridyl)benzofuran-2-yl]-(3-methylimidazol-4-yl)methyl]benzonitrile Formula: C31H22ClN5O MolecularWeight: 515.99228

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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)Cl)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)Cl)C6=CN=CC=C6)N

InChI

InChI=1S/C31H22ClN5O/c1-37-19-36-18-28(37)31(34,25-9-7-20(16-33)8-10-25)29-15-24-12-23(22-5-3-11-35-17-22)14-27(30(24)38-29)21-4-2-6-26(32)13-21/h2-15,17-19H,34H2,1H3