3-[azanyl-(4-dodecylphenyl)methyl]-1,3-benzothiazole-2-thione

Systemtic Name: 3-[azanyl-(4-dodecylphenyl)methyl]-1,3-benzothiazole-2-thione Openeye Name: 3-[amino-(4-dodecylphenyl)methyl]-1,3-benzothiazole-2-thione CAS Name: 3-[amino-(4-dodecylphenyl)methyl]-1,3-benzothiazole-2-thione IUPAC Name: 3-[amino-(4-dodecylphenyl)methyl]-1,3-benzothiazole-2-thione Traditional Name: 3-[amino-(4-laurylphenyl)methyl]-1,3-benzothiazole-2-thione Formula: C26H36N2S2 MolecularWeight: 440.70744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C(N)N2C3=CC=CC=C3SC2=S

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C(N)N2C3=CC=CC=C3SC2=S

InChI

InChI=1S/C26H36N2S2/c1-2-3-4-5-6-7-8-9-10-11-14-21-17-19-22(20-18-21)25(27)28-23-15-12-13-16-24(23)30-26(28)29/h12-13,15-20,25H,2-11,14,27H2,1H3