oxidanyl 3,5-bis[(2-butylphenyl)methyl]morpholine-4-carbodithioate

Systemtic Name: oxidanyl 3,5-bis[(2-butylphenyl)methyl]morpholine-4-carbodithioate Openeye Name: hydroxy 3,5-bis[(2-butylphenyl)methyl]morpholine-4-carbodithioate CAS Name: [3,5-bis[(2-butylphenyl)methyl]-4-morpholinyl]-sulfanylidenemethanesulfenic acid IUPAC Name: hydroxy 3,5-bis[(2-butylphenyl)methyl]morpholine-4-carbodithioate Traditional Name: 3,5-bis(2-butylbenzyl)morpholine-4-carbodithioic acid hydroxy ester Formula: C27H37NO2S2 MolecularWeight: 471.71818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1CC2COCC(N2C(=S)SO)CC3=CC=CC=C3CCCC

Isomeric SMILES

CCCCC1=CC=CC=C1CC2COCC(N2C(=S)SO)CC3=CC=CC=C3CCCC

InChI

InChI=1S/C27H37NO2S2/c1-3-5-11-21-13-7-9-15-23(21)17-25-19-30-20-26(28(25)27(31)32-29)18-24-16-10-8-14-22(24)12-6-4-2/h7-10,13-16,25-26,29H,3-6,11-12,17-20H2,1-2H3