3-[1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]pyrazol-3-yl]-1-phenyl-pyridazin-4-one

Systemtic Name: 3-[1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]pyrazol-3-yl]-1-phenyl-pyridazin-4-one Openeye Name: 3-[1-[(3S)-1,1-dioxothiolan-3-yl]pyrazol-3-yl]-1-phenyl-pyridazin-4-one CAS Name: 3-[1-[(3S)-1,1-dioxo-3-thiolanyl]-3-pyrazolyl]-1-phenyl-4-pyridazinone IUPAC Name: 3-[1-[(3S)-1,1-dioxothiolan-3-yl]pyrazol-3-yl]-1-phenylpyridazin-4-one Traditional Name: 3-[1-[(3S)-1,1-diketothiolan-3-yl]pyrazol-3-yl]-1-phenyl-pyridazin-4-one Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C=CC(=N2)C3=NN(C=CC3=O)C4=CC=CC=C4

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1N2C=CC(=N2)C3=NN(C=CC3=O)C4=CC=CC=C4

InChI

InChI=1S/C17H16N4O3S/c22-16-7-10-20(13-4-2-1-3-5-13)19-17(16)15-6-9-21(18-15)14-8-11-25(23,24)12-14/h1-7,9-10,14H,8,11-12H2/t14-/m0/s1