(2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-azanyl-3-naphthalen-2-yl-propanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-N-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-3-phenyl-propanamide

Systemtic Name: (2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-azanyl-3-naphthalen-2-yl-propanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-N-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-3-phenyl-propanamide Openeye Name: (2R)-N-[(1S)-2-amino-1-methyl-2-oxo-ethyl]-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-(2-naphthyl)propanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenyl-propanamide CAS Name: (2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-(2-naphthalenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-3-(1H-indol-3-yl)-1-oxopropyl]amino]-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-phenylpropanamide IUPAC Name: (2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-naphthalen-2-ylpropanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-N-[(2S)-1-amino-1-oxopropan-2-yl]-3-phenylpropanamide Traditional Name: (2R)-N-[(1S)-2-amino-2-keto-1-methyl-ethyl]-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-(2-naphthyl)propanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenyl-propionamide Formula: C39H43N7O5 MolecularWeight: 689.80262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C(C)NC(=O)C(CC4=CC5=CC=CC=C5C=C4)N

Isomeric SMILES

C[C@@H](C(=O)N)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](C)NC(=O)[C@@H](CC4=CC5=CC=CC=C5C=C4)N

InChI

InChI=1S/C39H43N7O5/c1-23(35(41)47)43-38(50)33(20-25-10-4-3-5-11-25)46-39(51)34(21-29-22-42-32-15-9-8-14-30(29)32)45-36(48)24(2)44-37(49)31(40)19-26-16-17-27-12-6-7-13-28(27)18-26/h3-18,22-24,31,33-34,42H,19-21,40H2,1-2H3,(H2,41,47)(H,43,50)(H,44,49)(H,45,48)(H,46,51)/t23-,24-,31+,33+,34-/m0/s1