4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 1-phenyl-4-[[5-(p-tolylsulfanyl)-2-furyl]methylene]pyrazolidine-3,5-dione CAS Name: 4-[[5-[(4-methylphenyl)thio]-2-furanyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 1-phenyl-4-[[5-(p-tolylthio)-2-furyl]methylene]pyrazolidine-3,5-quinone Formula: C21H16N2O3S MolecularWeight: 376.42834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=C(O2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=C(O2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O3S/c1-14-7-10-17(11-8-14)27-19-12-9-16(26-19)13-18-20(24)22-23(21(18)25)15-5-3-2-4-6-15/h2-13H,1H3,(H,22,24)