N-[[(2R)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N'-[[(2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N,N'-diphenethyl-decanediamide

Systemtic Name: N-[[(2R)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N'-[[(2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N,N'-diphenethyl-decanediamide Openeye Name: N-[[(2R)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N'-[[(2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N,N'-diphenethyl-decanediamide CAS Name: N-[[(2R)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-1-oxobutyl]-2-pyrrolidinyl]methyl]-N'-[[(2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)-1-oxopropyl]amino]-1-oxobutyl]-2-pyrrolidinyl]methyl]-N,N'-diphenethyldecanediamide IUPAC Name: N-[[(2R)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N'-[[(2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N,N'-diphenethyldecanediamide Traditional Name: N-[[(2R)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N'-[[(2S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]pyrrolidin-2-yl]methyl]-N,N'-diphenethyl-sebacamide Formula: C56H90N8O6 MolecularWeight: 971.3638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C(=O)N1CCCC1CN(CCC2=CC=CC=C2)C(=O)CCCCCCCCC(=O)N(CCC3=CC=CC=C3)CC4CCCN4C(=O)C(C(C)(C)C)NC(=O)C(C)NC)C(C)(C)C)NC

Isomeric SMILES

C[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@@H]1CN(CCC2=CC=CC=C2)C(=O)CCCCCCCCC(=O)N(CCC3=CC=CC=C3)C[C@@H]4CCCN4C(=O)[C@H](C(C)(C)C)NC(=O)[C@H](C)NC)C(C)(C)C)NC

InChI

InChI=1S/C56H90N8O6/c1-41(57-9)51(67)59-49(55(3,4)5)53(69)63-35-23-29-45(63)39-61(37-33-43-25-17-15-18-26-43)47(65)31-21-13-11-12-14-22-32-48(66)62(38-34-44-27-19-16-20-28-44)40-46-30-24-36-64(46)54(70)50(56(6,7)8)60-52(68)42(2)58-10/h15-20,25-28,41-42,45-46,49-50,57-58H,11-14,21-24,29-40H2,1-10H3,(H,59,67)(H,60,68)/t41-,42-,45-,46+,49+,50+/m0/s1