[2-(dipropylamino)-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-6-yl]iminoazanium

Systemtic Name: [2-(dipropylamino)-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-6-yl]iminoazanium Openeye Name: [2-(dipropylamino)-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-6-yl]iminoammonium CAS Name: [2-(dipropylamino)-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-6-yl]iminoammonium IUPAC Name: [2-(dipropylamino)-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-6-yl]iminoazanium Traditional Name: [2-(dipropylamino)-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-6-yl]iminoammonium Formula: C22H37N4OS+ MolecularWeight: 405.62038

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=NC2=CC(=C(C=C2S1)N=[NH2+])OCCC(C)CC(C)(C)C

Isomeric SMILES

CCCN(CCC)C1=NC2=CC(=C(C=C2S1)N=[NH2+])OCCC(C)CC(C)(C)C

InChI

InChI=1S/C22H36N4OS/c1-7-10-26(11-8-2)21-24-18-13-19(17(25-23)14-20(18)28-21)27-12-9-16(3)15-22(4,5)6/h13-14,16,23H,7-12,15H2,1-6H3/p+1