(phenylmethyl) 4-[5-[(4-tert-butylphenyl)carbonylamino]pyridin-2-yl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[5-[(4-tert-butylphenyl)carbonylamino]pyridin-2-yl]piperazine-1-carboxylate Openeye Name: benzyl 4-[5-[(4-tert-butylbenzoyl)amino]-2-pyridyl]piperazine-1-carboxylate CAS Name: 4-[5-[[(4-tert-butylphenyl)-oxomethyl]amino]-2-pyridinyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[5-[(4-tert-butylbenzoyl)amino]pyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[5-[(4-tert-butylbenzoyl)amino]-2-pyridyl]piperazine-1-carboxylic acid benzyl ester Formula: C28H32N4O3 MolecularWeight: 472.57868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H32N4O3/c1-28(2,3)23-11-9-22(10-12-23)26(33)30-24-13-14-25(29-19-24)31-15-17-32(18-16-31)27(34)35-20-21-7-5-4-6-8-21/h4-14,19H,15-18,20H2,1-3H3,(H,30,33)