[(3S)-5-(4-ethylphenyl)-3-quinoxalin-6-yl-3,4-dihydropyrazol-2-yl]-phenyl-methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C(C2)C3=CC4=NC=CN=C4C=C3)C(=O)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN([C@@H](C2)C3=CC4=NC=CN=C4C=C3)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H22N4O/c1-2-18-8-10-19(11-9-18)23-17-25(21-12-13-22-24(16-21)28-15-14-27-22)30(29-23)26(31)20-6-4-3-5-7-20/h3-16,25H,2,17H2,1H3/t25-/m0/s1