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

Systemtic Name: 6-[(5S)-5-(furan-2-yl)-1-methylsulfonyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[(5S)-5-(2-furyl)-1-methylsulfonyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(5S)-5-(2-furanyl)-1-methylsulfonyl-3-pyrazolidinylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(5S)-5-(furan-2-yl)-1-methylsulfonylpyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(5S)-5-(2-furyl)-1-mesyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(CC(=C2C=CC=CC2=O)N1)C3=CC=CO3

Isomeric SMILES

CS(=O)(=O)N1[C@@H](CC(=C2C=CC=CC2=O)N1)C3=CC=CO3

InChI

InChI=1S/C14H14N2O4S/c1-21(18,19)16-12(14-7-4-8-20-14)9-11(15-16)10-5-2-3-6-13(10)17/h2-8,12,15H,9H2,1H3/t12-/m0/s1