pyridin-3-ylmethyl N-[[4-[(3-azanyl-6-phenyl-pyridin-2-yl)carbamoyl]phenyl]methyl]carbamate

Systemtic Name: pyridin-3-ylmethyl N-[[4-[(3-azanyl-6-phenyl-pyridin-2-yl)carbamoyl]phenyl]methyl]carbamate Openeye Name: 3-pyridylmethyl N-[[4-[(3-amino-6-phenyl-2-pyridyl)carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[(3-amino-6-phenyl-2-pyridinyl)amino]-oxomethyl]phenyl]methyl]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[[4-[(3-amino-6-phenylpyridin-2-yl)carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[(3-amino-6-phenyl-2-pyridyl)carbamoyl]benzyl]carbamic acid 3-pyridylmethyl ester Formula: C26H23N5O3 MolecularWeight: 453.49252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C=C2)N)NC(=O)C3=CC=C(C=C3)CNC(=O)OCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C=C2)N)NC(=O)C3=CC=C(C=C3)CNC(=O)OCC4=CN=CC=C4

InChI

InChI=1S/C26H23N5O3/c27-22-12-13-23(20-6-2-1-3-7-20)30-24(22)31-25(32)21-10-8-18(9-11-21)16-29-26(33)34-17-19-5-4-14-28-15-19/h1-15H,16-17,27H2,(H,29,33)(H,30,31,32)