2-[(4-chloranyl-1,3-benzothiazol-2-yl)-(2-phenylethanoyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4-chloranyl-1,3-benzothiazol-2-yl)-(2-phenylethanoyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(4-chloro-1,3-benzothiazol-2-yl)-(2-phenylacetyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(4-chloro-1,3-benzothiazol-2-yl)-(1-oxo-2-phenylethyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-chloro-1,3-benzothiazol-2-yl)-(2-phenylacetyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(4-chloro-1,3-benzothiazol-2-yl)-(2-phenylacetyl)amino]ethyl-dimethyl-ammonium Formula: C19H21ClN3OS+ MolecularWeight: 374.90754

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H20ClN3OS/c1-22(2)11-12-23(17(24)13-14-7-4-3-5-8-14)19-21-18-15(20)9-6-10-16(18)25-19/h3-10H,11-13H2,1-2H3/p+1