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

Systemtic Name: pyridin-3-ylmethyl N-[[4-[(2-azanylpyridin-3-yl)carbamoyl]phenyl]methyl]carbamate Openeye Name: 3-pyridylmethyl N-[[4-[(2-amino-3-pyridyl)carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[(2-amino-3-pyridinyl)amino]-oxomethyl]phenyl]methyl]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[[4-[(2-aminopyridin-3-yl)carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[(2-amino-3-pyridyl)carbamoyl]benzyl]carbamic acid 3-pyridylmethyl ester Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC3=C(N=CC=C3)N

Isomeric SMILES

C1=CC(=CN=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC3=C(N=CC=C3)N

InChI

InChI=1S/C20H19N5O3/c21-18-17(4-2-10-23-18)25-19(26)16-7-5-14(6-8-16)12-24-20(27)28-13-15-3-1-9-22-11-15/h1-11H,12-13H2,(H2,21,23)(H,24,27)(H,25,26)