(2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]propyl]amino]-N-(2-azanyl-2-oxidanylidene-ethyl)-3-phenyl-propanamide

Systemtic Name: (2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]propyl]amino]-N-(2-azanyl-2-oxidanylidene-ethyl)-3-phenyl-propanamide Openeye Name: (2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]propyl]amino]-N-(2-amino-2-oxo-ethyl)-3-phenyl-propanamide CAS Name: (2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-(4-hydroxyphenyl)-1-oxopropyl]amino]propyl]amino]-N-(2-amino-2-oxoethyl)-3-phenylpropanamide IUPAC Name: (2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]propyl]amino]-N-(2-amino-2-oxoethyl)-3-phenylpropanamide Traditional Name: (2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]propyl]amino]-N-(2-amino-2-keto-ethyl)-3-phenyl-propionamide Formula: C25H33N5O5 MolecularWeight: 483.56002

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(CC1=CC=CC=C1)C(=O)NCC(=O)N)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C

Isomeric SMILES

C[C@H](CN[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)N)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)C

InChI

InChI=1S/C25H33N5O5/c1-16(29-25(35)22(30-17(2)31)13-19-8-10-20(32)11-9-19)14-27-21(24(34)28-15-23(26)33)12-18-6-4-3-5-7-18/h3-11,16,21-22,27,32H,12-15H2,1-2H3,(H2,26,33)(H,28,34)(H,29,35)(H,30,31)/t16-,21+,22+/m1/s1