1-[(3S)-3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone

Systemtic Name: 1-[(3S)-3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone Openeye Name: 1-[(3S)-3,5-bis(2-furyl)-3,4-dihydropyrazol-2-yl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone CAS Name: 1-[(3S)-3,5-bis(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-[(4-phenyl-1-phthalazinyl)thio]ethanone IUPAC Name: 1-[(3S)-3,5-bis(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-(4-phenylphthalazin-1-yl)sulfanylethanone Traditional Name: 1-[(5S)-3,5-bis(2-furyl)-2-pyrazolin-1-yl]-2-[(4-phenylphthalazin-1-yl)thio]ethanone Formula: C27H20N4O3S MolecularWeight: 480.5377

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CO2)C(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5)C6=CC=CO6

Isomeric SMILES

C1[C@H](N(N=C1C2=CC=CO2)C(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5)C6=CC=CO6

InChI

InChI=1S/C27H20N4O3S/c32-25(31-22(24-13-7-15-34-24)16-21(30-31)23-12-6-14-33-23)17-35-27-20-11-5-4-10-19(20)26(28-29-27)18-8-2-1-3-9-18/h1-15,22H,16-17H2/t22-/m0/s1