[3-(dioctylcarbamothioylsulfanylmethyl)-2,4,6-trimethyl-5-oxidanyl-phenyl]methyl N,N-dioctylcarbamodithioate

Systemtic Name: [3-(dioctylcarbamothioylsulfanylmethyl)-2,4,6-trimethyl-5-oxidanyl-phenyl]methyl N,N-dioctylcarbamodithioate Openeye Name: [3-(dioctylcarbamothioylsulfanylmethyl)-5-hydroxy-2,4,6-trimethyl-phenyl]methyl N,N-dioctylcarbamodithioate CAS Name: N,N-dioctylcarbamodithioic acid [3-[[[(dioctylamino)-sulfanylidenemethyl]thio]methyl]-5-hydroxy-2,4,6-trimethylphenyl]methyl ester IUPAC Name: [3-(dioctylcarbamothioylsulfanylmethyl)-5-hydroxy-2,4,6-trimethylphenyl]methyl N,N-dioctylcarbamodithioate Traditional Name: N,N-dioctylcarbamodithioic acid [3-[(dioctylthiocarbamoylthio)methyl]-5-hydroxy-2,4,6-trimethyl-benzyl] ester Formula: C45H82N2OS4 MolecularWeight: 795.40538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)C(=S)SCC1=C(C(=C(C(=C1C)O)C)CSC(=S)N(CCCCCCCC)CCCCCCCC)C

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)C(=S)SCC1=C(C(=C(C(=C1C)O)C)CSC(=S)N(CCCCCCCC)CCCCCCCC)C

InChI

InChI=1S/C45H82N2OS4/c1-8-12-16-20-24-28-32-46(33-29-25-21-17-13-9-2)44(49)51-36-41-38(5)42(40(7)43(48)39(41)6)37-52-45(50)47(34-30-26-22-18-14-10-3)35-31-27-23-19-15-11-4/h48H,8-37H2,1-7H3