1,3-benzothiazol-5-ylsulfonyl-cyclohexyl-dodecylsulfanyl-methoxy-azanium

Systemtic Name: 1,3-benzothiazol-5-ylsulfonyl-cyclohexyl-dodecylsulfanyl-methoxy-azanium Openeye Name: 1,3-benzothiazol-5-ylsulfonyl-cyclohexyl-dodecylsulfanyl-methoxy-ammonium CAS Name: 1,3-benzothiazol-5-ylsulfonyl-cyclohexyl-(dodecylthio)-methoxyammonium IUPAC Name: 1,3-benzothiazol-5-ylsulfonyl-cyclohexyl-dodecylsulfanyl-methoxyazanium Traditional Name: 1,3-benzothiazol-5-ylsulfonyl-cyclohexyl-(laurylthio)-methoxy-ammonium Formula: C26H43N2O3S3+ MolecularWeight: 527.82622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS[N+](C1CCCCC1)(OC)S(=O)(=O)C2=CC3=C(C=C2)SC=N3

Isomeric SMILES

CCCCCCCCCCCCS[N+](C1CCCCC1)(OC)S(=O)(=O)C2=CC3=C(C=C2)SC=N3

InChI

InChI=1S/C26H43N2O3S3/c1-3-4-5-6-7-8-9-10-11-15-20-33-28(31-2,23-16-13-12-14-17-23)34(29,30)24-18-19-26-25(21-24)27-22-32-26/h18-19,21-23H,3-17,20H2,1-2H3/q+1