[2,4,5-tris(diethylcarbamothioylsulfanylmethyl)phenyl]methyl N,N-diethylcarbamodithioate

Systemtic Name: [2,4,5-tris(diethylcarbamothioylsulfanylmethyl)phenyl]methyl N,N-diethylcarbamodithioate Openeye Name: [2,4,5-tris(diethylcarbamothioylsulfanylmethyl)phenyl]methyl N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2,4,5-tris[[[diethylamino(sulfanylidene)methyl]thio]methyl]phenyl]methyl ester IUPAC Name: [2,4,5-tris(diethylcarbamothioylsulfanylmethyl)phenyl]methyl N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2,4,5-tris[(diethylthiocarbamoylthio)methyl]benzyl] ester Formula: C30H50N4S8 MolecularWeight: 723.2648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC1=CC(=C(C=C1CSC(=S)N(CC)CC)CSC(=S)N(CC)CC)CSC(=S)N(CC)CC

Isomeric SMILES

CCN(CC)C(=S)SCC1=CC(=C(C=C1CSC(=S)N(CC)CC)CSC(=S)N(CC)CC)CSC(=S)N(CC)CC

InChI

InChI=1S/C30H50N4S8/c1-9-31(10-2)27(35)39-19-23-17-25(21-41-29(37)33(13-5)14-6)26(22-42-30(38)34(15-7)16-8)18-24(23)20-40-28(36)32(11-3)12-4/h17-18H,9-16,19-22H2,1-8H3