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3-[(2-oxidanyl-4-pentadecyl-phenyl)methyl]-1,3-benzothiazole-2-thione

3-[(2-oxidanyl-4-pentadecyl-phenyl)methyl]-1,3-benzothiazole-2-thione

Systemtic Name:3-[(2-oxidanyl-4-pentadecyl-phenyl)methyl]-1,3-benzothiazole-2-thione
Openeye Name:3-[(2-hydroxy-4-pentadecyl-phenyl)methyl]-1,3-benzothiazole-2-thione
CAS Name:3-[(2-hydroxy-4-pentadecylphenyl)methyl]-1,3-benzothiazole-2-thione
IUPAC Name:3-[(2-hydroxy-4-pentadecylphenyl)methyl]-1,3-benzothiazole-2-thione
Traditional Name:3-(2-hydroxy-4-pentadecyl-benzyl)-1,3-benzothiazole-2-thione
Formula: C29H41NOS2
MolecularWeight: 483.77194
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=C(C=C1)CN2C3=CC=CC=C3SC2=S)O


Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=C(C=C1)CN2C3=CC=CC=C3SC2=S)O


InChI

InChI=1S/C29H41NOS2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-20-21-25(27(31)22-24)23-30-26-18-15-16-19-28(26)33-29(30)32/h15-16,18-22,31H,2-14,17,23H2,1H3


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