1-[(3R)-3-(4-methoxyphenyl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]-2-quinolin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[(3R)-3-(4-methoxyphenyl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]-2-quinolin-2-ylsulfanyl-ethanone Openeye Name: 1-[(3R)-3-(4-methoxyphenyl)-5-(2-naphthyl)-3,4-dihydropyrazol-2-yl]-2-(2-quinolylsulfanyl)ethanone CAS Name: 1-[(3R)-3-(4-methoxyphenyl)-5-(2-naphthalenyl)-3,4-dihydropyrazol-2-yl]-2-(2-quinolinylthio)ethanone IUPAC Name: 1-[(3R)-3-(4-methoxyphenyl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]-2-quinolin-2-ylsulfanylethanone Traditional Name: 1-[(5R)-5-(4-methoxyphenyl)-3-(2-naphthyl)-2-pyrazolin-1-yl]-2-(2-quinolylthio)ethanone Formula: C31H25N3O2S MolecularWeight: 503.6141

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=NC4=CC=CC=C4C=C3)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CC(=NN2C(=O)CSC3=NC4=CC=CC=C4C=C3)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C31H25N3O2S/c1-36-26-15-12-23(13-16-26)29-19-28(25-11-10-21-6-2-3-8-24(21)18-25)33-34(29)31(35)20-37-30-17-14-22-7-4-5-9-27(22)32-30/h2-18,29H,19-20H2,1H3/t29-/m1/s1