tert-butyl N-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-N-[6-azanyl-2-[(5-oxidanylidenepyrrolidin-2-yl)carbonylamino]hexanoyl]carbamate

Systemtic Name: tert-butyl N-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-N-[6-azanyl-2-[(5-oxidanylidenepyrrolidin-2-yl)carbonylamino]hexanoyl]carbamate Openeye Name: tert-butyl N-(2-amino-1-benzyl-2-oxo-ethyl)-N-[6-amino-2-[(5-oxopyrrolidine-2-carbonyl)amino]hexanoyl]carbamate CAS Name: N-[6-amino-1-oxo-2-[[oxo-(5-oxo-2-pyrrolidinyl)methyl]amino]hexyl]-N-(1-amino-1-oxo-3-phenylpropan-2-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-amino-1-oxo-3-phenylpropan-2-yl)-N-[6-amino-2-[(5-oxopyrrolidine-2-carbonyl)amino]hexanoyl]carbamate Traditional Name: N-(2-amino-1-benzyl-2-keto-ethyl)-N-[6-amino-2-(pyroglutamoylamino)hexanoyl]carbamic acid tert-butyl ester Formula: C25H37N5O6 MolecularWeight: 503.59118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(CC1=CC=CC=C1)C(=O)N)C(=O)C(CCCCN)NC(=O)C2CCC(=O)N2

Isomeric SMILES

CC(C)(C)OC(=O)N(C(CC1=CC=CC=C1)C(=O)N)C(=O)C(CCCCN)NC(=O)C2CCC(=O)N2

InChI

InChI=1S/C25H37N5O6/c1-25(2,3)36-24(35)30(19(21(27)32)15-16-9-5-4-6-10-16)23(34)18(11-7-8-14-26)29-22(33)17-12-13-20(31)28-17/h4-6,9-10,17-19H,7-8,11-15,26H2,1-3H3,(H2,27,32)(H,28,31)(H,29,33)