tert-butyl N-[(2S)-1-[[(2S)-1-[[(2S)-5-azanyl-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1,5-bis(oxidanylidene)pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[[(2S)-1-[[(2S)-5-azanyl-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1,5-bis(oxidanylidene)pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[[[(1S)-2-[[(1S)-4-amino-1-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]amino]-1-benzyl-2-oxo-ethyl]amino]methyl]-2-phenyl-ethyl]carbamate CAS Name: N-[(2S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-[[[(1S)-2-[[(1S)-4-amino-1-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]carbamoyl]-4-keto-butyl]amino]-1-benzyl-2-keto-ethyl]amino]methyl]-2-phenyl-ethyl]carbamic acid tert-butyl ester Formula: C37H48N6O6 MolecularWeight: 672.81362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CNC(CC2=CC=CC=C2)C(=O)NC(CCC(=O)N)C(=O)NC(CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C37H48N6O6/c1-37(2,3)49-36(48)41-28(21-25-13-7-4-8-14-25)24-40-31(23-27-17-11-6-12-18-27)35(47)42-29(19-20-32(38)44)34(46)43-30(33(39)45)22-26-15-9-5-10-16-26/h4-18,28-31,40H,19-24H2,1-3H3,(H2,38,44)(H2,39,45)(H,41,48)(H,42,47)(H,43,46)/t28-,29-,30-,31-/m0/s1