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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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