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

Systemtic Name: methyl 4-[[[1-(4-pyrrolidin-1-ylphenyl)pyrazol-4-yl]carbonylamino]carbamoyl]benzoate Openeye Name: methyl 4-[[[1-(4-pyrrolidin-1-ylphenyl)pyrazole-4-carbonyl]amino]carbamoyl]benzoate CAS Name: 4-[oxo-[[oxo-[1-[4-(1-pyrrolidinyl)phenyl]-4-pyrazolyl]methyl]hydrazo]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(4-pyrrolidin-1-ylphenyl)pyrazole-4-carbonyl]amino]carbamoyl]benzoate Traditional Name: 4-[[[1-(4-pyrrolidinophenyl)pyrazole-4-carbonyl]amino]carbamoyl]benzoic acid methyl ester Formula: C23H23N5O4 MolecularWeight: 433.45982

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)N4CCCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CN(N=C2)C3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C23H23N5O4/c1-32-23(31)17-6-4-16(5-7-17)21(29)25-26-22(30)18-14-24-28(15-18)20-10-8-19(9-11-20)27-12-2-3-13-27/h4-11,14-15H,2-3,12-13H2,1H3,(H,25,29)(H,26,30)