(2R)-N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-(2-methylpropyl)-2-phenyl-cyclopropane-1-carboxamide

Systemtic Name: (2R)-N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-(2-methylpropyl)-2-phenyl-cyclopropane-1-carboxamide Openeye Name: (2R)-N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-isobutyl-2-phenyl-cyclopropanecarboxamide CAS Name: (2R)-N-[[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-4-pyrazolyl]methyl]-N-(2-methylpropyl)-2-phenyl-1-cyclopropanecarboxamide IUPAC Name: (2R)-N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenylpyrazol-4-yl]methyl]-N-(2-methylpropyl)-2-phenylcyclopropane-1-carboxamide Traditional Name: (2R)-N-[[5-(4-ethylpiperazino)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-isobutyl-2-phenyl-cyclopropanecarboxamide Formula: C31H41N5O MolecularWeight: 499.69014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=NN2C3=CC=CC=C3)C)CN(CC(C)C)C(=O)C4CC4C5=CC=CC=C5

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=NN2C3=CC=CC=C3)C)CN(CC(C)C)C(=O)C4C[C@H]4C5=CC=CC=C5

InChI

InChI=1S/C31H41N5O/c1-5-33-16-18-34(19-17-33)30-29(24(4)32-36(30)26-14-10-7-11-15-26)22-35(21-23(2)3)31(37)28-20-27(28)25-12-8-6-9-13-25/h6-15,23,27-28H,5,16-22H2,1-4H3/t27-,28?/m0/s1