methyl 2-[[4-[(1-pyrimidin-2-ylpiperidin-4-yl)carbonylamino]phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[4-[(1-pyrimidin-2-ylpiperidin-4-yl)carbonylamino]phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-[(1-pyrimidin-2-ylpiperidine-4-carbonyl)amino]benzoyl]amino]acetate CAS Name: 2-[[oxo-[4-[[oxo-[1-(2-pyrimidinyl)-4-piperidinyl]methyl]amino]phenyl]methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[(1-pyrimidin-2-ylpiperidine-4-carbonyl)amino]benzoyl]amino]acetate Traditional Name: 2-[[4-[[1-(2-pyrimidyl)isonipecotoyl]amino]benzoyl]amino]acetic acid methyl ester Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C20H23N5O4/c1-29-17(26)13-23-18(27)14-3-5-16(6-4-14)24-19(28)15-7-11-25(12-8-15)20-21-9-2-10-22-20/h2-6,9-10,15H,7-8,11-13H2,1H3,(H,23,27)(H,24,28)