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

Systemtic Name: tert-butyl N-[(2S)-4-[[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-4-phenyl-butyl]-(phenylmethyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-3-[benzyl-[(3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]amino]-2-oxo-propyl]carbamate CAS Name: N-[(2S)-3-hydroxy-4-[[(3S)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-4-phenylbutyl]-(phenylmethyl)amino]-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-4-[benzyl-[(3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenylbutyl]amino]-3-oxo-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-3-[benzyl-[(3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]amino]-2-keto-propyl]carbamic acid tert-butyl ester Formula: C37H49N3O6 MolecularWeight: 631.80146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CN(CC2=CC=CC=C2)CC(=O)C(CC3=CC=CC=C3)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(CN(CC2=CC=CC=C2)CC(=O)[C@H](CC3=CC=CC=C3)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C37H49N3O6/c1-36(2,3)45-34(43)38-30(22-27-16-10-7-11-17-27)32(41)25-40(24-29-20-14-9-15-21-29)26-33(42)31(23-28-18-12-8-13-19-28)39-35(44)46-37(4,5)6/h7-21,30-32,41H,22-26H2,1-6H3,(H,38,43)(H,39,44)/t30-,31-,32?/m0/s1