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

Systemtic Name: pyridin-2-ylmethyl N-[(2S)-3-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-3-methyl-2-(pyridin-2-ylmethoxycarbonylamino)butanoyl]amino]-2-phenyl-ethyl]oxiran-2-yl]-2-phenyl-ethyl]amino]-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: 2-pyridylmethyl N-[(1S)-2-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-3-methyl-2-(2-pyridylmethoxycarbonylamino)butanoyl]amino]-2-phenyl-ethyl]oxiran-2-yl]-2-phenyl-ethyl]carbamoyl]propyl]carbamate CAS Name: N-[(2S)-3-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-3-methyl-1-oxo-2-[[oxo(2-pyridinylmethoxy)methyl]amino]butyl]amino]-2-phenylethyl]-2-oxiranyl]-2-phenylethyl]amino]-1-oxobutan-2-yl]carbamic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl N-[(2S)-3-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-3-methyl-2-(pyridin-2-ylmethoxycarbonylamino)butanoyl]amino]-2-phenylethyl]oxiran-2-yl]-2-phenylethyl]amino]-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-2-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-3-methyl-2-(2-pyridylmethoxycarbonylamino)butanoyl]amino]-2-phenyl-ethyl]oxiran-2-yl]-2-phenyl-ethyl]carbamoyl]propyl]carbamic acid 2-pyridylmethyl ester Formula: C42H50N6O7 MolecularWeight: 750.8824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C2C(O2)C(CC3=CC=CC=C3)NC(=O)C(C(C)C)NC(=O)OCC4=CC=CC=N4)NC(=O)OCC5=CC=CC=N5

Isomeric SMILES

CC(C)[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](C(C)C)NC(=O)OCC4=CC=CC=N4)NC(=O)OCC5=CC=CC=N5

InChI

InChI=1S/C42H50N6O7/c1-27(2)35(47-41(51)53-25-31-19-11-13-21-43-31)39(49)45-33(23-29-15-7-5-8-16-29)37-38(55-37)34(24-30-17-9-6-10-18-30)46-40(50)36(28(3)4)48-42(52)54-26-32-20-12-14-22-44-32/h5-22,27-28,33-38H,23-26H2,1-4H3,(H,45,49)(H,46,50)(H,47,51)(H,48,52)/t33-,34-,35-,36-,37-,38+/m0/s1