(2S)-N-(3-azanylpropyl)-3-phenyl-2-[2-[(4-phenylphenyl)methylamino]ethanoylamino]propanamide

Systemtic Name: (2S)-N-(3-azanylpropyl)-3-phenyl-2-[2-[(4-phenylphenyl)methylamino]ethanoylamino]propanamide Openeye Name: (2S)-N-(3-aminopropyl)-3-phenyl-2-[[2-[(4-phenylphenyl)methylamino]acetyl]amino]propanamide CAS Name: (2S)-N-(3-aminopropyl)-2-[[1-oxo-2-[(4-phenylphenyl)methylamino]ethyl]amino]-3-phenylpropanamide IUPAC Name: (2S)-N-(3-aminopropyl)-3-phenyl-2-[[2-[(4-phenylphenyl)methylamino]acetyl]amino]propanamide Traditional Name: (2S)-N-(3-aminopropyl)-3-phenyl-2-[[2-[(4-phenylbenzyl)amino]acetyl]amino]propionamide Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCCN)NC(=O)CNCC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NCCCN)NC(=O)CNCC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H32N4O2/c28-16-7-17-30-27(33)25(18-21-8-3-1-4-9-21)31-26(32)20-29-19-22-12-14-24(15-13-22)23-10-5-2-6-11-23/h1-6,8-15,25,29H,7,16-20,28H2,(H,30,33)(H,31,32)/t25-/m0/s1