4-[[5-[[2-azanylethyl-[(3S)-2-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[2-azanylethyl-[(3S)-2-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[2-aminoethyl-[(3S)-1-benzyl-2-oxo-pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[2-aminoethyl-[(3S)-2-oxo-1-(phenylmethyl)-3-pyrrolidinyl]amino]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[2-aminoethyl-[(3S)-1-benzyl-2-oxopyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[2-aminoethyl-[(3S)-1-benzyl-2-keto-pyrrolidin-3-yl]amino]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C25H28N6O MolecularWeight: 428.52942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1N(CCN)CC2=CN=CN2CC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

Isomeric SMILES

C1CN(C(=O)[C@H]1N(CCN)CC2=CN=CN2CC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N6O/c26-11-13-29(24-10-12-30(25(24)32)16-21-4-2-1-3-5-21)18-23-15-28-19-31(23)17-22-8-6-20(14-27)7-9-22/h1-9,15,19,24H,10-13,16-18,26H2/t24-/m0/s1