2-[4-[(2-methyl-1-sulfosulfanyl-propan-2-yl)amino]butyl]-1,3-bis(oxidanylidene)isoindole

Systemtic Name: 2-[4-[(2-methyl-1-sulfosulfanyl-propan-2-yl)amino]butyl]-1,3-bis(oxidanylidene)isoindole Openeye Name: 2-[4-[(1,1-dimethyl-2-sulfosulfanyl-ethyl)amino]butyl]-1,3-dioxo-isoindoline CAS Name: 2-[4-[[2-methyl-1-(sulfothio)propan-2-yl]amino]butyl]-1,3-dioxoisoindole IUPAC Name: 2-[4-[(2-methyl-1-sulfosulfanylpropan-2-yl)amino]butyl]-1,3-dioxoisoindole Traditional Name: 2-[4-[[1,1-dimethyl-2-(sulfothio)ethyl]amino]butyl]-1,3-diketo-isoindoline Formula: C16H22N2O5S2 MolecularWeight: 386.48628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CSS(=O)(=O)O)NCCCCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)(CSS(=O)(=O)O)NCCCCN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C16H22N2O5S2/c1-16(2,11-24-25(21,22)23)17-9-5-6-10-18-14(19)12-7-3-4-8-13(12)15(18)20/h3-4,7-8,17H,5-6,9-11H2,1-2H3,(H,21,22,23)