quinolin-2-ylmethyl N-[(2S)-1-oxidanylidene-1-[[(1S)-2-phenyl-1-[(2S,3R)-3-[(1S)-2-phenyl-1-[[(2S)-2-(quinolin-2-ylmethoxycarbonylamino)butanoyl]amino]ethyl]oxiran-2-yl]ethyl]amino]butan-2-yl]carbamate

Systemtic Name: quinolin-2-ylmethyl N-[(2S)-1-oxidanylidene-1-[[(1S)-2-phenyl-1-[(2S,3R)-3-[(1S)-2-phenyl-1-[[(2S)-2-(quinolin-2-ylmethoxycarbonylamino)butanoyl]amino]ethyl]oxiran-2-yl]ethyl]amino]butan-2-yl]carbamate Openeye Name: 2-quinolylmethyl N-[(1S)-1-[[(1S)-2-phenyl-1-[(2S,3R)-3-[(1S)-2-phenyl-1-[[(2S)-2-(2-quinolylmethoxycarbonylamino)butanoyl]amino]ethyl]oxiran-2-yl]ethyl]carbamoyl]propyl]carbamate CAS Name: N-[(2S)-1-oxo-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-1-oxo-2-[[oxo(2-quinolinylmethoxy)methyl]amino]butyl]amino]-2-phenylethyl]-2-oxiranyl]-2-phenylethyl]amino]butan-2-yl]carbamic acid 2-quinolinylmethyl ester IUPAC Name: quinolin-2-ylmethyl N-[(2S)-1-oxo-1-[[(1S)-2-phenyl-1-[(2S,3R)-3-[(1S)-2-phenyl-1-[[(2S)-2-(quinolin-2-ylmethoxycarbonylamino)butanoyl]amino]ethyl]oxiran-2-yl]ethyl]amino]butan-2-yl]carbamate Traditional Name: N-[(1S)-1-[[(1S)-2-phenyl-1-[(2S,3R)-3-[(1S)-2-phenyl-1-[[(2S)-2-(2-quinolylmethoxycarbonylamino)butanoyl]amino]ethyl]oxiran-2-yl]ethyl]carbamoyl]propyl]carbamic acid 2-quinolylmethyl ester Formula: C48H50N6O7 MolecularWeight: 822.9466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(CC1=CC=CC=C1)C2C(O2)C(CC3=CC=CC=C3)NC(=O)C(CC)NC(=O)OCC4=NC5=CC=CC=C5C=C4)NC(=O)OCC6=NC7=CC=CC=C7C=C6

Isomeric SMILES

CC[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@H]2[C@H](O2)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](CC)NC(=O)OCC4=NC5=CC=CC=C5C=C4)NC(=O)OCC6=NC7=CC=CC=C7C=C6

InChI

InChI=1S/C48H50N6O7/c1-3-37(53-47(57)59-29-35-25-23-33-19-11-13-21-39(33)49-35)45(55)51-41(27-31-15-7-5-8-16-31)43-44(61-43)42(28-32-17-9-6-10-18-32)52-46(56)38(4-2)54-48(58)60-30-36-26-24-34-20-12-14-22-40(34)50-36/h5-26,37-38,41-44H,3-4,27-30H2,1-2H3,(H,51,55)(H,52,56)(H,53,57)(H,54,58)/t37-,38-,41-,42-,43-,44+/m0/s1