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

Systemtic Name: (4-methylphenyl)methyl N-[[4-[(2-azanylpyridin-3-yl)carbamoyl]phenyl]methyl]carbamate Openeye Name: p-tolylmethyl N-[[4-[(2-amino-3-pyridyl)carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[[(2-amino-3-pyridinyl)amino]-oxomethyl]phenyl]methyl]carbamic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl N-[[4-[(2-aminopyridin-3-yl)carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[(2-amino-3-pyridyl)carbamoyl]benzyl]carbamic acid (4-methylbenzyl) ester Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC3=C(N=CC=C3)N

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC3=C(N=CC=C3)N

InChI

InChI=1S/C22H22N4O3/c1-15-4-6-17(7-5-15)14-29-22(28)25-13-16-8-10-18(11-9-16)21(27)26-19-3-2-12-24-20(19)23/h2-12H,13-14H2,1H3,(H2,23,24)(H,25,28)(H,26,27)