1-oxidanylidene-7-[2-(6-phenoxyhexylamino)ethyl]-2,3-dihydro-1,3-benzothiazol-4-ol hydrochloride

Systemtic Name: 1-oxidanylidene-7-[2-(6-phenoxyhexylamino)ethyl]-2,3-dihydro-1,3-benzothiazol-4-ol hydrochloride Openeye Name: 1-oxo-7-[2-(6-phenoxyhexylamino)ethyl]-2,3-dihydro-1,3-benzothiazol-4-ol hydrochloride CAS Name: 1-oxo-7-[2-(6-phenoxyhexylamino)ethyl]-2,3-dihydro-1,3-benzothiazol-4-ol hydrochloride IUPAC Name: 1-oxo-7-[2-(6-phenoxyhexylamino)ethyl]-2,3-dihydro-1,3-benzothiazol-4-ol hydrochloride Traditional Name: 1-keto-7-[2-(6-phenoxyhexylamino)ethyl]-2,3-dihydro-1,3-benzothiazol-4-ol hydrochloride Formula: C21H29ClN2O3S MolecularWeight: 424.98456

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2=C(C=CC(=C2S1=O)CCNCCCCCCOC3=CC=CC=C3)O.Cl

Isomeric SMILES

C1NC2=C(C=CC(=C2S1=O)CCNCCCCCCOC3=CC=CC=C3)O.Cl

InChI

InChI=1S/C21H28N2O3S.ClH/c24-19-11-10-17(21-20(19)23-16-27(21)25)12-14-22-13-6-1-2-7-15-26-18-8-4-3-5-9-18;/h3-5,8-11,22-24H,1-2,6-7,12-16H2;1H