N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-5-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methylamino]pentanamide

Systemtic Name: N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-5-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methylamino]pentanamide Openeye Name: N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-5-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methylamino]pentanamide CAS Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-[[3-[(4-cyanophenyl)methyl]-4-imidazolyl]methylamino]pentanamide IUPAC Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methylamino]pentanamide Traditional Name: N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-5-[[3-(4-cyanobenzyl)imidazol-4-yl]methylamino]valeramide Formula: C26H30N6O2 MolecularWeight: 458.5554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N)NC(=O)CCCCNCC2=CN=CN2CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)CCCCNCC2=CN=CN2CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H30N6O2/c27-15-21-9-11-22(12-10-21)18-32-19-30-17-23(32)16-29-13-5-4-8-25(33)31-24(26(28)34)14-20-6-2-1-3-7-20/h1-3,6-7,9-12,17,19,24,29H,4-5,8,13-14,16,18H2,(H2,28,34)(H,31,33)/t24-/m0/s1