4-[[5-[[[(3R)-1-naphthalen-1-ylcarbonyl-2-oxidanylidene-pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[[(3R)-1-naphthalen-1-ylcarbonyl-2-oxidanylidene-pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[[(3R)-1-(naphthalene-1-carbonyl)-2-oxo-pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[[(3R)-1-[1-naphthalenyl(oxo)methyl]-2-oxo-3-pyrrolidinyl]amino]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[[(3R)-1-(naphthalene-1-carbonyl)-2-oxopyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[[(3R)-2-keto-1-(1-naphthoyl)pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C27H23N5O2 MolecularWeight: 449.50382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1NCC2=CN=CN2CC3=CC=C(C=C3)C#N)C(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(C(=O)[C@@H]1NCC2=CN=CN2CC3=CC=C(C=C3)C#N)C(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H23N5O2/c28-14-19-8-10-20(11-9-19)17-31-18-29-15-22(31)16-30-25-12-13-32(27(25)34)26(33)24-7-3-5-21-4-1-2-6-23(21)24/h1-11,15,18,25,30H,12-13,16-17H2/t25-/m1/s1