(2R)-2-[[(2S)-2-azanyl-3-(2-azanylethoxy)propanoyl]amino]-4-phenyl-N-quinolin-3-yl-butanamide

Systemtic Name: (2R)-2-[[(2S)-2-azanyl-3-(2-azanylethoxy)propanoyl]amino]-4-phenyl-N-quinolin-3-yl-butanamide Openeye Name: (2R)-2-[[(2S)-2-amino-3-(2-aminoethoxy)propanoyl]amino]-4-phenyl-N-(3-quinolyl)butanamide CAS Name: (2R)-2-[[(2S)-2-amino-3-(2-aminoethoxy)-1-oxopropyl]amino]-4-phenyl-N-(3-quinolinyl)butanamide IUPAC Name: (2R)-2-[[(2S)-2-amino-3-(2-aminoethoxy)propanoyl]amino]-4-phenyl-N-quinolin-3-ylbutanamide Traditional Name: (2R)-2-[[(2S)-2-amino-3-(2-aminoethoxy)propanoyl]amino]-4-phenyl-N-(3-quinolyl)butyramide Formula: C24H29N5O3 MolecularWeight: 435.51876

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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(COCCN)N

Isomeric SMILES

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

InChI

InChI=1S/C24H29N5O3/c25-12-13-32-16-20(26)23(30)29-22(11-10-17-6-2-1-3-7-17)24(31)28-19-14-18-8-4-5-9-21(18)27-15-19/h1-9,14-15,20,22H,10-13,16,25-26H2,(H,28,31)(H,29,30)/t20-,22+/m0/s1