2-(1-azanylethyl)-1,1-dimethyl-1-oxidanylidene-3-(6-phenethyloxyhexyl)-2H-1,3-benzothiazol-4-ol

Systemtic Name: 2-(1-azanylethyl)-1,1-dimethyl-1-oxidanylidene-3-(6-phenethyloxyhexyl)-2H-1,3-benzothiazol-4-ol Openeye Name: 2-(1-aminoethyl)-1,1-dimethyl-1-oxo-3-(6-phenethyloxyhexyl)-2H-1,3-benzothiazol-4-ol CAS Name: 2-(1-aminoethyl)-1,1-dimethyl-1-oxo-3-(6-phenethyloxyhexyl)-2H-1,3-benzothiazol-4-ol IUPAC Name: 2-(1-aminoethyl)-1,1-dimethyl-1-oxo-3-(6-phenethyloxyhexyl)-2H-1,3-benzothiazol-4-ol Traditional Name: 2-(1-aminoethyl)-1-keto-1,1-dimethyl-3-(6-phenethyloxyhexyl)-2H-1,3-benzothiazol-4-ol Formula: C25H38N2O3S MolecularWeight: 446.64582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1N(C2=C(C=CC=C2S1(=O)(C)C)O)CCCCCCOCCC3=CC=CC=C3)N

Isomeric SMILES

CC(C1N(C2=C(C=CC=C2S1(=O)(C)C)O)CCCCCCOCCC3=CC=CC=C3)N

InChI

InChI=1S/C25H38N2O3S/c1-20(26)25-27(24-22(28)14-11-15-23(24)31(25,2,3)29)17-9-4-5-10-18-30-19-16-21-12-7-6-8-13-21/h6-8,11-15,20,25,28H,4-5,9-10,16-19,26H2,1-3H3