4-(1-methylsulfanylethyl)-1,2-diphenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-(1-methylsulfanylethyl)-1,2-diphenyl-pyrazolidine-3,5-dione Openeye Name: 4-(1-methylsulfanylethyl)-1,2-diphenyl-pyrazolidine-3,5-dione CAS Name: 4-[1-(methylthio)ethyl]-1,2-diphenylpyrazolidine-3,5-dione IUPAC Name: 4-(1-methylsulfanylethyl)-1,2-diphenylpyrazolidine-3,5-dione Traditional Name: 4-[1-(methylthio)ethyl]-1,2-diphenyl-pyrazolidine-3,5-quinone Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)SC

Isomeric SMILES

CC(C1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)SC

InChI

InChI=1S/C18H18N2O2S/c1-13(23-2)16-17(21)19(14-9-5-3-6-10-14)20(18(16)22)15-11-7-4-8-12-15/h3-13,16H,1-2H3