3,6-bis(2-ethyldecyl)-4-methyl-octanebis(thioic S-acid)

Systemtic Name: 3,6-bis(2-ethyldecyl)-4-methyl-octanebis(thioic S-acid) Openeye Name: 3,6-bis(2-ethyldecyl)-4-methyl-octanebis(thioic S-acid) CAS Name: 3,6-bis(2-ethyldecyl)-4-methyloctanebis(thioic S-acid) IUPAC Name: 3,6-bis(2-ethyldecyl)-4-methyloctanebis(thioic S-acid) Traditional Name: 3,6-bis(2-ethyldecyl)-4-methyl-octanebis(thioic S-acid) Formula: C33H64O2S2 MolecularWeight: 556.99006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC)CC(CC(C)C(CC(CC)CCCCCCCC)CC(=O)S)CC(=O)S

Isomeric SMILES

CCCCCCCCC(CC)CC(CC(C)C(CC(CC)CCCCCCCC)CC(=O)S)CC(=O)S

InChI

InChI=1S/C33H64O2S2/c1-6-10-12-14-16-18-20-28(8-3)23-30(25-32(34)36)22-27(5)31(26-33(35)37)24-29(9-4)21-19-17-15-13-11-7-2/h27-31H,6-26H2,1-5H3,(H,34,36)(H,35,37)