N-ethyl-4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N-propyl-aniline

Systemtic Name: N-ethyl-4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N-propyl-aniline Openeye Name: N-ethyl-4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)azo]-N-propyl-aniline CAS Name: N-ethyl-4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)azo]-N-propylaniline IUPAC Name: N-ethyl-4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N-propylaniline Traditional Name: ethyl-[4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)azo]phenyl]-propyl-amine Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C3=C(S2)C=C(C=C3)OC)C

Isomeric SMILES

CCCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C3=C(S2)C=C(C=C3)OC)C

InChI

InChI=1S/C20H25N4OS/c1-5-13-24(6-2)16-9-7-15(8-10-16)21-22-20-23(3)18-12-11-17(25-4)14-19(18)26-20/h7-12,14H,5-6,13H2,1-4H3/q+1