methyl 4-[[[1-(4-piperidin-1-ylphenyl)pyrazol-4-yl]carbonylamino]carbamoyl]benzoate

Systemtic Name: methyl 4-[[[1-(4-piperidin-1-ylphenyl)pyrazol-4-yl]carbonylamino]carbamoyl]benzoate Openeye Name: methyl 4-[[[1-[4-(1-piperidyl)phenyl]pyrazole-4-carbonyl]amino]carbamoyl]benzoate CAS Name: 4-[oxo-[[oxo-[1-[4-(1-piperidinyl)phenyl]-4-pyrazolyl]methyl]hydrazo]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(4-piperidin-1-ylphenyl)pyrazole-4-carbonyl]amino]carbamoyl]benzoate Traditional Name: 4-[[[1-(4-piperidinophenyl)pyrazole-4-carbonyl]amino]carbamoyl]benzoic acid methyl ester Formula: C24H25N5O4 MolecularWeight: 447.4864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C24H25N5O4/c1-33-24(32)18-7-5-17(6-8-18)22(30)26-27-23(31)19-15-25-29(16-19)21-11-9-20(10-12-21)28-13-3-2-4-14-28/h5-12,15-16H,2-4,13-14H2,1H3,(H,26,30)(H,27,31)