4-[bis(butylsulfanyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[bis(butylsulfanyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[bis(butylsulfanyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[bis(butylthio)methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[bis(butylsulfanyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[bis(butylthio)methylene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C18H24N2O2S2 MolecularWeight: 364.52536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=C1C(=O)NN(C1=O)C2=CC=CC=C2)SCCCC

Isomeric SMILES

CCCCSC(=C1C(=O)NN(C1=O)C2=CC=CC=C2)SCCCC

InChI

InChI=1S/C18H24N2O2S2/c1-3-5-12-23-18(24-13-6-4-2)15-16(21)19-20(17(15)22)14-10-8-7-9-11-14/h7-11H,3-6,12-13H2,1-2H3,(H,19,21)