tert-butyl N-[(3-azanyl-2-oxidanyl-4-phenyl-butyl)-[(4-pyridin-2-ylphenyl)methyl]amino]carbamate

Systemtic Name: tert-butyl N-[(3-azanyl-2-oxidanyl-4-phenyl-butyl)-[(4-pyridin-2-ylphenyl)methyl]amino]carbamate Openeye Name: tert-butyl N-[(3-amino-2-hydroxy-4-phenyl-butyl)-[[4-(2-pyridyl)phenyl]methyl]amino]carbamate CAS Name: N-[(3-amino-2-hydroxy-4-phenylbutyl)-[[4-(2-pyridinyl)phenyl]methyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3-amino-2-hydroxy-4-phenylbutyl)-[(4-pyridin-2-ylphenyl)methyl]amino]carbamate Traditional Name: N-[(3-amino-2-hydroxy-4-phenyl-butyl)-[4-(2-pyridyl)benzyl]amino]carbamic acid tert-butyl ester Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN(CC1=CC=C(C=C1)C2=CC=CC=N2)CC(C(CC3=CC=CC=C3)N)O

Isomeric SMILES

CC(C)(C)OC(=O)NN(CC1=CC=C(C=C1)C2=CC=CC=N2)CC(C(CC3=CC=CC=C3)N)O

InChI

InChI=1S/C27H34N4O3/c1-27(2,3)34-26(33)30-31(19-25(32)23(28)17-20-9-5-4-6-10-20)18-21-12-14-22(15-13-21)24-11-7-8-16-29-24/h4-16,23,25,32H,17-19,28H2,1-3H3,(H,30,33)