(2S)-2-[[(2S)-2-(phenethylcarbamoylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propanamide

Systemtic Name: (2S)-2-[[(2S)-2-(phenethylcarbamoylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propanamide Openeye Name: (2S)-2-[[(2S)-2-(phenethylcarbamoylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propanamide CAS Name: (2S)-2-[[(2S)-1-oxo-2-[[oxo-(phenethylamino)methyl]amino]-3-phenylpropyl]amino]-3-phenylpropanamide IUPAC Name: (2S)-2-[[(2S)-2-(phenethylcarbamoylamino)-3-phenylpropanoyl]amino]-3-phenylpropanamide Traditional Name: (2S)-2-[[(2S)-2-(phenethylcarbamoylamino)-3-phenyl-propanoyl]amino]-3-phenyl-propionamide Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C27H30N4O3/c28-25(32)23(18-21-12-6-2-7-13-21)30-26(33)24(19-22-14-8-3-9-15-22)31-27(34)29-17-16-20-10-4-1-5-11-20/h1-15,23-24H,16-19H2,(H2,28,32)(H,30,33)(H2,29,31,34)/t23-,24-/m0/s1