3,6-bis[bis(butylsulfanyl)methylidene]piperazine-2,5-dione

Systemtic Name: 3,6-bis[bis(butylsulfanyl)methylidene]piperazine-2,5-dione Openeye Name: 3,6-bis[bis(butylsulfanyl)methylene]piperazine-2,5-dione CAS Name: 3,6-bis[bis(butylthio)methylidene]piperazine-2,5-dione IUPAC Name: 3,6-bis[bis(butylsulfanyl)methylidene]piperazine-2,5-dione Traditional Name: 3,6-bis[bis(butylthio)methylene]piperazine-2,5-quinone Formula: C22H38N2O2S4 MolecularWeight: 490.80932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=C1C(=O)NC(=C(SCCCC)SCCCC)C(=O)N1)SCCCC

Isomeric SMILES

CCCCSC(=C1C(=O)NC(=C(SCCCC)SCCCC)C(=O)N1)SCCCC

InChI

InChI=1S/C22H38N2O2S4/c1-5-9-13-27-21(28-14-10-6-2)17-19(25)24-18(20(26)23-17)22(29-15-11-7-3)30-16-12-8-4/h5-16H2,1-4H3,(H,23,26)(H,24,25)