3-phenyl-1-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]propan-1-one

Systemtic Name: 3-phenyl-1-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]propan-1-one Openeye Name: 3-phenyl-1-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]propan-1-one CAS Name: 3-phenyl-1-[(3S)-5-phenyl-3-(6-quinoxalinyl)-3,4-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 3-phenyl-1-[(3S)-5-phenyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]propan-1-one Traditional Name: 3-phenyl-1-[(5S)-3-phenyl-5-quinoxalin-6-yl-2-pyrazolin-1-yl]propan-1-one Formula: C26H22N4O MolecularWeight: 406.47908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CC=C2)C(=O)CCC3=CC=CC=C3)C4=CC5=NC=CN=C5C=C4

Isomeric SMILES

C1[C@H](N(N=C1C2=CC=CC=C2)C(=O)CCC3=CC=CC=C3)C4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C26H22N4O/c31-26(14-11-19-7-3-1-4-8-19)30-25(18-23(29-30)20-9-5-2-6-10-20)21-12-13-22-24(17-21)28-16-15-27-22/h1-10,12-13,15-17,25H,11,14,18H2/t25-/m0/s1