N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-5-(pyridin-4-ylmethylamino)pentanamide

Systemtic Name: N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-5-(pyridin-4-ylmethylamino)pentanamide Openeye Name: N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-5-(4-pyridylmethylamino)pentanamide CAS Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-(pyridin-4-ylmethylamino)pentanamide IUPAC Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-(pyridin-4-ylmethylamino)pentanamide Traditional Name: N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-5-(4-pyridylmethylamino)valeramide Formula: C20H26N4O2 MolecularWeight: 354.44604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N)NC(=O)CCCCNCC2=CC=NC=C2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)CCCCNCC2=CC=NC=C2

InChI

InChI=1S/C20H26N4O2/c21-20(26)18(14-16-6-2-1-3-7-16)24-19(25)8-4-5-11-23-15-17-9-12-22-13-10-17/h1-3,6-7,9-10,12-13,18,23H,4-5,8,11,14-15H2,(H2,21,26)(H,24,25)/t18-/m0/s1