4-[[5-[(3-naphthalen-1-ylcarbonylpyrrol-1-yl)methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[(3-naphthalen-1-ylcarbonylpyrrol-1-yl)methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[3-(naphthalene-1-carbonyl)pyrrol-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[3-[1-naphthalenyl(oxo)methyl]-1-pyrrolyl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[3-(naphthalene-1-carbonyl)pyrrol-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[3-(1-naphthoyl)pyrrol-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C27H20N4O MolecularWeight: 416.4739

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)C3=CN(C=C3)CC4=CN=CN4CC5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)C3=CN(C=C3)CC4=CN=CN4CC5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H20N4O/c28-14-20-8-10-21(11-9-20)16-31-19-29-15-24(31)18-30-13-12-23(17-30)27(32)26-7-3-5-22-4-1-2-6-25(22)26/h1-13,15,17,19H,16,18H2