6,7-bis(ethylsulfanyl)-2-(1-ethylsulfanyl-4-methyl-pent-3-enyl)-5,8-bis(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 6,7-bis(ethylsulfanyl)-2-(1-ethylsulfanyl-4-methyl-pent-3-enyl)-5,8-bis(oxidanyl)naphthalene-1,4-dione Openeye Name: 6,7-bis(ethylsulfanyl)-2-(1-ethylsulfanyl-4-methyl-pent-3-enyl)-5,8-dihydroxy-naphthalene-1,4-dione CAS Name: 6,7-bis(ethylthio)-2-[1-(ethylthio)-4-methylpent-3-enyl]-5,8-dihydroxynaphthalene-1,4-dione IUPAC Name: 6,7-bis(ethylsulfanyl)-2-(1-ethylsulfanyl-4-methylpent-3-enyl)-5,8-dihydroxynaphthalene-1,4-dione Traditional Name: 6,7-bis(ethylthio)-2-[1-(ethylthio)-4-methyl-pent-3-enyl]-5,8-dihydroxy-1,4-naphthoquinone Formula: C22H28O4S3 MolecularWeight: 452.65032

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C2=C(C(=C1SCC)O)C(=O)C(=CC2=O)C(CC=C(C)C)SCC)O

Isomeric SMILES

CCSC1=C(C2=C(C(=C1SCC)O)C(=O)C(=CC2=O)C(CC=C(C)C)SCC)O

InChI

InChI=1S/C22H28O4S3/c1-6-27-15(10-9-12(4)5)13-11-14(23)16-17(18(13)24)20(26)22(29-8-3)21(19(16)25)28-7-2/h9,11,15,25-26H,6-8,10H2,1-5H3