[4-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-5-methoxy-phenyl]carbonylpiperazin-1-yl]-(2-phenylquinolin-4-yl)methanone

Systemtic Name: [4-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-5-methoxy-phenyl]carbonylpiperazin-1-yl]-(2-phenylquinolin-4-yl)methanone Openeye Name: [4-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-5-methoxy-benzoyl]piperazin-1-yl]-(2-phenyl-4-quinolyl)methanone CAS Name: [4-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-5-methoxyphenyl]-oxomethyl]-1-piperazinyl]-(2-phenyl-4-quinolinyl)methanone IUPAC Name: [4-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-5-methoxybenzoyl]piperazin-1-yl]-(2-phenylquinolin-4-yl)methanone Traditional Name: [4-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-5-methoxy-benzoyl]piperazino]-(2-phenyl-4-quinolyl)methanone Formula: C39H35N5O3 MolecularWeight: 621.7269

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3=C(C=C(C=C3)OC)C(=O)N4CCN(CC4)C(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=CC=C7

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3=C(C=C(C=C3)OC)C(=O)N4CCN(CC4)C(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=CC=C7

InChI

InChI=1S/C39H35N5O3/c1-26-37(27(2)44(41-26)29-14-8-5-9-15-29)32-19-18-30(47-3)24-33(32)38(45)42-20-22-43(23-21-42)39(46)34-25-36(28-12-6-4-7-13-28)40-35-17-11-10-16-31(34)35/h4-19,24-25H,20-23H2,1-3H3