(1-phenyl-5-propyl-pyrazol-4-yl)-[4-(3-phenylquinoxalin-2-yl)piperazin-1-yl]methanone

Systemtic Name: (1-phenyl-5-propyl-pyrazol-4-yl)-[4-(3-phenylquinoxalin-2-yl)piperazin-1-yl]methanone Openeye Name: (1-phenyl-5-propyl-pyrazol-4-yl)-[4-(3-phenylquinoxalin-2-yl)piperazin-1-yl]methanone CAS Name: (1-phenyl-5-propyl-4-pyrazolyl)-[4-(3-phenyl-2-quinoxalinyl)-1-piperazinyl]methanone IUPAC Name: (1-phenyl-5-propylpyrazol-4-yl)-[4-(3-phenylquinoxalin-2-yl)piperazin-1-yl]methanone Traditional Name: (1-phenyl-5-propyl-pyrazol-4-yl)-[4-(3-phenylquinoxalin-2-yl)piperazino]methanone Formula: C31H30N6O MolecularWeight: 502.6095

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC5=CC=CC=C5N=C4C6=CC=CC=C6

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC5=CC=CC=C5N=C4C6=CC=CC=C6

InChI

InChI=1S/C31H30N6O/c1-2-11-28-25(22-32-37(28)24-14-7-4-8-15-24)31(38)36-20-18-35(19-21-36)30-29(23-12-5-3-6-13-23)33-26-16-9-10-17-27(26)34-30/h3-10,12-17,22H,2,11,18-21H2,1H3