(4Z)-1-(hexylsulfanylmethyl)-2-(3-hexylsulfanylpropyl)-4-(oxidanylmethylidene)pyrazolidine-3,5-dione

Systemtic Name: (4Z)-1-(hexylsulfanylmethyl)-2-(3-hexylsulfanylpropyl)-4-(oxidanylmethylidene)pyrazolidine-3,5-dione Openeye Name: (4Z)-1-(hexylsulfanylmethyl)-2-(3-hexylsulfanylpropyl)-4-(hydroxymethylene)pyrazolidine-3,5-dione CAS Name: (4Z)-1-[(hexylthio)methyl]-2-[3-(hexylthio)propyl]-4-(hydroxymethylidene)pyrazolidine-3,5-dione IUPAC Name: (4Z)-1-(hexylsulfanylmethyl)-2-(3-hexylsulfanylpropyl)-4-(hydroxymethylidene)pyrazolidine-3,5-dione Traditional Name: (4Z)-1-[(hexylthio)methyl]-2-[3-(hexylthio)propyl]-4-(hydroxymethylene)pyrazolidine-3,5-quinone Formula: C20H36N2O3S2 MolecularWeight: 416.64144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSCCCN1C(=O)C(=CO)C(=O)N1CSCCCCCC

Isomeric SMILES

CCCCCCSCCCN1C(=O)/C(=C/O)/C(=O)N1CSCCCCCC

InChI

InChI=1S/C20H36N2O3S2/c1-3-5-7-9-13-26-15-11-12-21-19(24)18(16-23)20(25)22(21)17-27-14-10-8-6-4-2/h16,23H,3-15,17H2,1-2H3/b18-16-