(2S)-3-phenyl-2-[3-(pyridin-4-ylmethylamino)propanoylamino]propanamide

Systemtic Name: (2S)-3-phenyl-2-[3-(pyridin-4-ylmethylamino)propanoylamino]propanamide Openeye Name: (2S)-3-phenyl-2-[3-(4-pyridylmethylamino)propanoylamino]propanamide CAS Name: (2S)-2-[[1-oxo-3-(pyridin-4-ylmethylamino)propyl]amino]-3-phenylpropanamide IUPAC Name: (2S)-3-phenyl-2-[3-(pyridin-4-ylmethylamino)propanoylamino]propanamide Traditional Name: (2S)-3-phenyl-2-[3-(4-pyridylmethylamino)propanoylamino]propionamide Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N)NC(=O)CCNCC2=CC=NC=C2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)CCNCC2=CC=NC=C2

InChI

InChI=1S/C18H22N4O2/c19-18(24)16(12-14-4-2-1-3-5-14)22-17(23)8-11-21-13-15-6-9-20-10-7-15/h1-7,9-10,16,21H,8,11-13H2,(H2,19,24)(H,22,23)/t16-/m0/s1