tert-butyl N-[2-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-(2-azanylpropanoyl)amino]-5-oxidanyl-3-phenyl-phenyl]carbamate

Systemtic Name: tert-butyl N-[2-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-(2-azanylpropanoyl)amino]-5-oxidanyl-3-phenyl-phenyl]carbamate Openeye Name: tert-butyl N-[2-[(2-amino-1-benzyl-2-oxo-ethyl)-(2-aminopropanoyl)amino]-5-hydroxy-3-phenyl-phenyl]carbamate CAS Name: N-[2-[(1-amino-1-oxo-3-phenylpropan-2-yl)-(2-amino-1-oxopropyl)amino]-5-hydroxy-3-phenylphenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[(1-amino-1-oxo-3-phenylpropan-2-yl)-(2-aminopropanoyl)amino]-5-hydroxy-3-phenylphenyl]carbamate Traditional Name: N-[2-[alanyl-(2-amino-1-benzyl-2-keto-ethyl)amino]-5-hydroxy-3-phenyl-phenyl]carbamic acid tert-butyl ester Formula: C29H34N4O5 MolecularWeight: 518.60406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1=C(C=C(C=C1C2=CC=CC=C2)O)NC(=O)OC(C)(C)C)C(CC3=CC=CC=C3)C(=O)N)N

Isomeric SMILES

CC(C(=O)N(C1=C(C=C(C=C1C2=CC=CC=C2)O)NC(=O)OC(C)(C)C)C(CC3=CC=CC=C3)C(=O)N)N

InChI

InChI=1S/C29H34N4O5/c1-18(30)27(36)33(24(26(31)35)15-19-11-7-5-8-12-19)25-22(20-13-9-6-10-14-20)16-21(34)17-23(25)32-28(37)38-29(2,3)4/h5-14,16-18,24,34H,15,30H2,1-4H3,(H2,31,35)(H,32,37)