4-[2-[(4-phenyl-1H-imidazol-5-yl)methyl]-1,2-diazepan-1-yl]naphthalene-1-carbonitrile

Systemtic Name: 4-[2-[(4-phenyl-1H-imidazol-5-yl)methyl]-1,2-diazepan-1-yl]naphthalene-1-carbonitrile Openeye Name: 4-[2-[(4-phenyl-1H-imidazol-5-yl)methyl]diazepan-1-yl]naphthalene-1-carbonitrile CAS Name: 4-[2-[(4-phenyl-1H-imidazol-5-yl)methyl]-1-diazepanyl]-1-naphthalenecarbonitrile IUPAC Name: 4-[2-[(4-phenyl-1H-imidazol-5-yl)methyl]diazepan-1-yl]naphthalene-1-carbonitrile Traditional Name: 4-[2-[(4-phenyl-1H-imidazol-5-yl)methyl]diazepan-1-yl]naphthalene-1-carbonitrile Formula: C26H25N5 MolecularWeight: 407.5102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(N(CC1)C2=CC=C(C3=CC=CC=C32)C#N)CC4=C(N=CN4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(N(CC1)C2=CC=C(C3=CC=CC=C32)C#N)CC4=C(N=CN4)C5=CC=CC=C5

InChI

InChI=1S/C26H25N5/c27-17-21-13-14-25(23-12-6-5-11-22(21)23)31-16-8-2-7-15-30(31)18-24-26(29-19-28-24)20-9-3-1-4-10-20/h1,3-6,9-14,19H,2,7-8,15-16,18H2,(H,28,29)