1,3-benzothiazol-2-ylmethyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-[2-(3-chlorophenyl)ethylamino]-2-keto-ethyl]-methyl-ammonium Formula: C19H21ClN3OS+ MolecularWeight: 374.90754

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NCCC3=CC(=CC=C3)Cl

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NCCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H20ClN3OS/c1-23(13-19-22-16-7-2-3-8-17(16)25-19)12-18(24)21-10-9-14-5-4-6-15(20)11-14/h2-8,11H,9-10,12-13H2,1H3,(H,21,24)/p+1