(2R)-2-[2-[(2R,4S)-4-azanylpyrrolidin-2-yl]ethanoylamino]-4-phenyl-N-quinolin-3-yl-butanamide

Systemtic Name: (2R)-2-[2-[(2R,4S)-4-azanylpyrrolidin-2-yl]ethanoylamino]-4-phenyl-N-quinolin-3-yl-butanamide Openeye Name: (2R)-2-[[2-[(2R,4S)-4-aminopyrrolidin-2-yl]acetyl]amino]-4-phenyl-N-(3-quinolyl)butanamide CAS Name: (2R)-2-[[2-[(2R,4S)-4-amino-2-pyrrolidinyl]-1-oxoethyl]amino]-4-phenyl-N-(3-quinolinyl)butanamide IUPAC Name: (2R)-2-[[2-[(2R,4S)-4-aminopyrrolidin-2-yl]acetyl]amino]-4-phenyl-N-quinolin-3-ylbutanamide Traditional Name: (2R)-2-[[2-[(2R,4S)-4-aminopyrrolidin-2-yl]acetyl]amino]-4-phenyl-N-(3-quinolyl)butyramide Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1CC(=O)NC(CCC2=CC=CC=C2)C(=O)NC3=CC4=CC=CC=C4N=C3)N

Isomeric SMILES

C1[C@@H](CN[C@H]1CC(=O)N[C@H](CCC2=CC=CC=C2)C(=O)NC3=CC4=CC=CC=C4N=C3)N

InChI

InChI=1S/C25H29N5O2/c26-19-13-20(27-15-19)14-24(31)30-23(11-10-17-6-2-1-3-7-17)25(32)29-21-12-18-8-4-5-9-22(18)28-16-21/h1-9,12,16,19-20,23,27H,10-11,13-15,26H2,(H,29,32)(H,30,31)/t19-,20+,23+/m0/s1