pyridin-2-ylmethyl N-[(2S)-4-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-4-methyl-2-(pyridin-2-ylmethoxycarbonylamino)pentanoyl]amino]-2-phenyl-ethyl]oxiran-2-yl]-2-phenyl-ethyl]amino]-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: pyridin-2-ylmethyl N-[(2S)-4-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-4-methyl-2-(pyridin-2-ylmethoxycarbonylamino)pentanoyl]amino]-2-phenyl-ethyl]oxiran-2-yl]-2-phenyl-ethyl]amino]-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: 2-pyridylmethyl N-[(1S)-3-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-4-methyl-2-(2-pyridylmethoxycarbonylamino)pentanoyl]amino]-2-phenyl-ethyl]oxiran-2-yl]-2-phenyl-ethyl]carbamoyl]butyl]carbamate CAS Name: N-[(2S)-4-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-4-methyl-1-oxo-2-[[oxo(2-pyridinylmethoxy)methyl]amino]pentyl]amino]-2-phenylethyl]-2-oxiranyl]-2-phenylethyl]amino]-1-oxopentan-2-yl]carbamic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl N-[(2S)-4-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-4-methyl-2-(pyridin-2-ylmethoxycarbonylamino)pentanoyl]amino]-2-phenylethyl]oxiran-2-yl]-2-phenylethyl]amino]-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-3-methyl-1-[[(1S)-1-[(2S,3R)-3-[(1S)-1-[[(2S)-4-methyl-2-(2-pyridylmethoxycarbonylamino)pentanoyl]amino]-2-phenyl-ethyl]oxiran-2-yl]-2-phenyl-ethyl]carbamoyl]butyl]carbamic acid 2-pyridylmethyl ester Formula: C44H54N6O7 MolecularWeight: 778.93556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C44H54N6O7/c1-29(2)23-37(49-43(53)55-27-33-19-11-13-21-45-33)41(51)47-35(25-31-15-7-5-8-16-31)39-40(57-39)36(26-32-17-9-6-10-18-32)48-42(52)38(24-30(3)4)50-44(54)56-28-34-20-12-14-22-46-34/h5-22,29-30,35-40H,23-28H2,1-4H3,(H,47,51)(H,48,52)(H,49,53)(H,50,54)/t35-,36-,37-,38-,39-,40+/m0/s1