tert-butyl N-[2-[[4-[(pyridin-3-ylmethylcarbamoylamino)methyl]phenyl]carbonylamino]phenyl]carbamate

Systemtic Name: tert-butyl N-[2-[[4-[(pyridin-3-ylmethylcarbamoylamino)methyl]phenyl]carbonylamino]phenyl]carbamate Openeye Name: tert-butyl N-[2-[[4-[(3-pyridylmethylcarbamoylamino)methyl]benzoyl]amino]phenyl]carbamate CAS Name: N-[2-[[oxo-[4-[[[oxo-(3-pyridinylmethylamino)methyl]amino]methyl]phenyl]methyl]amino]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[[4-[(pyridin-3-ylmethylcarbamoylamino)methyl]benzoyl]amino]phenyl]carbamate Traditional Name: N-[2-[[4-[(3-pyridylmethylcarbamoylamino)methyl]benzoyl]amino]phenyl]carbamic acid tert-butyl ester Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CNC(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CNC(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C26H29N5O4/c1-26(2,3)35-25(34)31-22-9-5-4-8-21(22)30-23(32)20-12-10-18(11-13-20)16-28-24(33)29-17-19-7-6-14-27-15-19/h4-15H,16-17H2,1-3H3,(H,30,32)(H,31,34)(H2,28,29,33)