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

Systemtic Name: (2S)-3-phenyl-2-[3-(quinolin-3-ylmethylamino)propanoylamino]propanamide Openeye Name: (2S)-3-phenyl-2-[3-(3-quinolylmethylamino)propanoylamino]propanamide CAS Name: (2S)-2-[[1-oxo-3-(3-quinolinylmethylamino)propyl]amino]-3-phenylpropanamide IUPAC Name: (2S)-3-phenyl-2-[3-(quinolin-3-ylmethylamino)propanoylamino]propanamide Traditional Name: (2S)-3-phenyl-2-[3-(3-quinolylmethylamino)propanoylamino]propionamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N)NC(=O)CCNCC2=CC3=CC=CC=C3N=C2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)CCNCC2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C22H24N4O2/c23-22(28)20(13-16-6-2-1-3-7-16)26-21(27)10-11-24-14-17-12-18-8-4-5-9-19(18)25-15-17/h1-9,12,15,20,24H,10-11,13-14H2,(H2,23,28)(H,26,27)/t20-/m0/s1