4-[[5-[[[(3S)-1-naphthalen-1-ylcarbonylpyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[[(3S)-1-naphthalen-1-ylcarbonylpyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[[(3S)-1-(naphthalene-1-carbonyl)pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[[(3S)-1-[1-naphthalenyl(oxo)methyl]-3-pyrrolidinyl]amino]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[[(3S)-1-(naphthalene-1-carbonyl)pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[[(3S)-1-(1-naphthoyl)pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C27H25N5O MolecularWeight: 435.5203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NCC2=CN=CN2CC3=CC=C(C=C3)C#N)C(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

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

InChI

InChI=1S/C27H25N5O/c28-14-20-8-10-21(11-9-20)17-32-19-29-15-24(32)16-30-23-12-13-31(18-23)27(33)26-7-3-5-22-4-1-2-6-25(22)26/h1-11,15,19,23,30H,12-13,16-18H2/t23-/m0/s1