sodium; 4-[[2-[(4-sulfinobutyldisulfanyl)methyl]phenyl]methyldisulfanyl]butane-1-sulfinic acid

Systemtic Name: sodium; 4-[[2-[(4-sulfinobutyldisulfanyl)methyl]phenyl]methyldisulfanyl]butane-1-sulfinic acid Openeye Name: sodium; 4-[[2-[(4-sulfinobutyldisulfanyl)methyl]phenyl]methyldisulfanyl]butane-1-sulfinic acid CAS Name: sodium; 4-[[2-[(4-sulfinobutyldisulfanyl)methyl]phenyl]methyldisulfanyl]-1-butanesulfinic acid IUPAC Name: sodium; 4-[[2-[(4-sulfinobutyldisulfanyl)methyl]phenyl]methyldisulfanyl]butane-1-sulfinic acid Traditional Name: sodium; 4-[[2-[(4-sulfinobutyldisulfanyl)methyl]benzyl]disulfanyl]butane-1-sulfinic acid Formula: C16H26NaO4S6 MolecularWeight: 497.75501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSSCCCCS(=O)O)CSSCCCCS(=O)O.[Na]

Isomeric SMILES

C1=CC=C(C(=C1)CSSCCCCS(=O)O)CSSCCCCS(=O)O.[Na]

InChI

InChI=1S/C16H26O4S6.Na/c17-25(18)11-5-3-9-21-23-13-15-7-1-2-8-16(15)14-24-22-10-4-6-12-26(19)20;/h1-2,7-8H,3-6,9-14H2,(H,17,18)(H,19,20);