6-[(5S)-1-methylsulfonyl-5-phenyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(5S)-1-methylsulfonyl-5-phenyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[(5S)-1-methylsulfonyl-5-phenyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(5S)-1-methylsulfonyl-5-phenyl-3-pyrazolidinylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(5S)-1-methylsulfonyl-5-phenylpyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(5S)-1-mesyl-5-phenyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(CC(=C2C=CC=CC2=O)N1)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N1[C@@H](CC(=C2C=CC=CC2=O)N1)C3=CC=CC=C3

InChI

InChI=1S/C16H16N2O3S/c1-22(20,21)18-15(12-7-3-2-4-8-12)11-14(17-18)13-9-5-6-10-16(13)19/h2-10,15,17H,11H2,1H3/t15-/m0/s1