(phenylmethyl) 3-oxidanylidene-4-[(2-phenylpyrimidin-5-yl)carbonylamino]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-oxidanylidene-4-[(2-phenylpyrimidin-5-yl)carbonylamino]piperazine-1-carboxylate Openeye Name: benzyl 3-oxo-4-[(2-phenylpyrimidine-5-carbonyl)amino]piperazine-1-carboxylate CAS Name: 3-oxo-4-[[oxo-(2-phenyl-5-pyrimidinyl)methyl]amino]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-oxo-4-[(2-phenylpyrimidine-5-carbonyl)amino]piperazine-1-carboxylate Traditional Name: 3-keto-4-[(2-phenylpyrimidine-5-carbonyl)amino]piperazine-1-carboxylic acid benzyl ester Formula: C23H21N5O4 MolecularWeight: 431.44394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1C(=O)OCC2=CC=CC=C2)NC(=O)C3=CN=C(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(C(=O)CN1C(=O)OCC2=CC=CC=C2)NC(=O)C3=CN=C(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H21N5O4/c29-20-15-27(23(31)32-16-17-7-3-1-4-8-17)11-12-28(20)26-22(30)19-13-24-21(25-14-19)18-9-5-2-6-10-18/h1-10,13-14H,11-12,15-16H2,(H,26,30)