2-[ethyl-[4-[(6-methoxy-3-methyl-2H-1,3-benzothiazol-2-yl)diazenyl]phenyl]amino]ethyl-trimethyl-azanium

Systemtic Name: 2-[ethyl-[4-[(6-methoxy-3-methyl-2H-1,3-benzothiazol-2-yl)diazenyl]phenyl]amino]ethyl-trimethyl-azanium Openeye Name: 2-[N-ethyl-4-[(6-methoxy-3-methyl-2H-1,3-benzothiazol-2-yl)azo]anilino]ethyl-trimethyl-ammonium CAS Name: 2-[N-ethyl-4-[(6-methoxy-3-methyl-2H-1,3-benzothiazol-2-yl)azo]anilino]ethyl-trimethylammonium IUPAC Name: 2-[N-ethyl-4-[(6-methoxy-3-methyl-2H-1,3-benzothiazol-2-yl)diazenyl]anilino]ethyl-trimethylazanium Traditional Name: 2-[N-ethyl-4-[(6-methoxy-3-methyl-2H-1,3-benzothiazol-2-yl)azo]anilino]ethyl-trimethyl-ammonium Formula: C22H32N5OS+ MolecularWeight: 414.58738

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2N(C3=C(S2)C=C(C=C3)OC)C

Isomeric SMILES

CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2N(C3=C(S2)C=C(C=C3)OC)C

InChI

InChI=1S/C22H32N5OS/c1-7-26(14-15-27(3,4)5)18-10-8-17(9-11-18)23-24-22-25(2)20-13-12-19(28-6)16-21(20)29-22/h8-13,16,22H,7,14-15H2,1-6H3/q+1