(2R)-2-[[(2S)-2,4-bis(azanyl)butanoyl]amino]-4-phenyl-N-quinolin-3-yl-butanamide

Systemtic Name: (2R)-2-[[(2S)-2,4-bis(azanyl)butanoyl]amino]-4-phenyl-N-quinolin-3-yl-butanamide Openeye Name: (2R)-2-[[(2S)-2,4-diaminobutanoyl]amino]-4-phenyl-N-(3-quinolyl)butanamide CAS Name: (2R)-2-[[(2S)-2,4-diamino-1-oxobutyl]amino]-4-phenyl-N-(3-quinolinyl)butanamide IUPAC Name: (2R)-2-[[(2S)-2,4-diaminobutanoyl]amino]-4-phenyl-N-quinolin-3-ylbutanamide Traditional Name: (2R)-2-[[(2S)-2,4-diaminobutanoyl]amino]-4-phenyl-N-(3-quinolyl)butyramide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)NC2=CC3=CC=CC=C3N=C2)NC(=O)C(CCN)N

Isomeric SMILES

C1=CC=C(C=C1)CC[C@H](C(=O)NC2=CC3=CC=CC=C3N=C2)NC(=O)[C@H](CCN)N

InChI

InChI=1S/C23H27N5O2/c24-13-12-19(25)22(29)28-21(11-10-16-6-2-1-3-7-16)23(30)27-18-14-17-8-4-5-9-20(17)26-15-18/h1-9,14-15,19,21H,10-13,24-25H2,(H,27,30)(H,28,29)/t19-,21+/m0/s1