methyl 2-[[4-[[1-(phenylmethyl)pyrazol-4-yl]carbonylamino]phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[4-[[1-(phenylmethyl)pyrazol-4-yl]carbonylamino]phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-[(1-benzylpyrazole-4-carbonyl)amino]benzoyl]amino]acetate CAS Name: 2-[[oxo-[4-[[oxo-[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]phenyl]methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[(1-benzylpyrazole-4-carbonyl)amino]benzoyl]amino]acetate Traditional Name: 2-[[4-[(1-benzylpyrazole-4-carbonyl)amino]benzoyl]amino]acetic acid methyl ester Formula: C21H20N4O4 MolecularWeight: 392.4079

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H20N4O4/c1-29-19(26)12-22-20(27)16-7-9-18(10-8-16)24-21(28)17-11-23-25(14-17)13-15-5-3-2-4-6-15/h2-11,14H,12-13H2,1H3,(H,22,27)(H,24,28)