(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)-octadecyl-carbamothioic S-acid

Systemtic Name: (3-tert-butyl-5-methyl-4-oxidanyl-phenyl)-octadecyl-carbamothioic S-acid Openeye Name: (3-tert-butyl-4-hydroxy-5-methyl-phenyl)-octadecyl-carbamothioic S-acid CAS Name: (3-tert-butyl-4-hydroxy-5-methylphenyl)-octadecylcarbamothioic S-acid IUPAC Name: (3-tert-butyl-4-hydroxy-5-methylphenyl)-octadecylcarbamothioic S-acid Traditional Name: (3-tert-butyl-4-hydroxy-5-methyl-phenyl)-stearyl-thiocarbamic S-acid Formula: C30H53NO2S MolecularWeight: 491.81232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C1=CC(=C(C(=C1)C)O)C(C)(C)C)C(=O)S

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C1=CC(=C(C(=C1)C)O)C(C)(C)C)C(=O)S

InChI

InChI=1S/C30H53NO2S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-31(29(33)34)26-23-25(2)28(32)27(24-26)30(3,4)5/h23-24,32H,6-22H2,1-5H3,(H,33,34)