(phenylmethyl) N-[(2S)-3,3-dimethyl-1-[[(2S,3R)-4-[[(2R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-4-phenyl-butyl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-3,3-dimethyl-1-[[(2S,3R)-4-[[(2R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-4-phenyl-butyl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-1-benzyl-3-[[(2R,3S)-3-[[(2S)-2-(benzyloxycarbonylamino)-3,3-dimethyl-butanoyl]amino]-2-hydroxy-4-phenyl-butyl]amino]-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3R)-4-[[(2R,3S)-3-[[(2S)-3,3-dimethyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-2-hydroxy-4-phenylbutyl]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R)-4-[[(2R,3S)-3-[[(2S)-3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-2-hydroxy-4-phenylbutyl]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-3-[[(2R,3S)-3-[[(2S)-2-(benzyloxycarbonylamino)-3,3-dimethyl-butanoyl]amino]-2-hydroxy-4-phenyl-butyl]amino]-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C39H54N4O7 MolecularWeight: 690.86866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)NC(CC1=CC=CC=C1)C(CNCC(C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](CNC[C@H]([C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C39H54N4O7/c1-38(2,3)34(43-36(47)49-26-29-20-14-9-15-21-29)35(46)41-30(22-27-16-10-7-11-17-27)32(44)24-40-25-33(45)31(23-28-18-12-8-13-19-28)42-37(48)50-39(4,5)6/h7-21,30-34,40,44-45H,22-26H2,1-6H3,(H,41,46)(H,42,48)(H,43,47)/t30-,31-,32+,33+,34+/m0/s1