2,5-bis(aziridin-1-yl)-3,6-bis(propylsulfanyl)cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,5-bis(aziridin-1-yl)-3,6-bis(propylsulfanyl)cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,5-bis(aziridin-1-yl)-3,6-bis(propylsulfanyl)-1,4-benzoquinone CAS Name: 2,5-bis(1-aziridinyl)-3,6-bis(propylthio)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,5-bis(aziridin-1-yl)-3,6-bis(propylsulfanyl)cyclohexa-2,5-diene-1,4-dione Traditional Name: 2,5-diethylenimino-3,6-bis(propylthio)-p-benzoquinone Formula: C16H22N2O2S2 MolecularWeight: 338.48808

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C(=O)C(=C(C1=O)N2CC2)SCCC)N3CC3

Isomeric SMILES

CCCSC1=C(C(=O)C(=C(C1=O)N2CC2)SCCC)N3CC3

InChI

InChI=1S/C16H22N2O2S2/c1-3-9-21-15-11(17-5-6-17)14(20)16(22-10-4-2)12(13(15)19)18-7-8-18/h3-10H2,1-2H3