2-[(5,6-dimethyl-1,3-benzothiazol-2-yl)-(phenylcarbonyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5,6-dimethyl-1,3-benzothiazol-2-yl)-(phenylcarbonyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[benzoyl-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[benzoyl-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]ethyl-dimethylammonium IUPAC Name: 2-[benzoyl-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[benzoyl-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-ammonium Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CC[NH+](C)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CC[NH+](C)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23N3OS/c1-14-12-17-18(13-15(14)2)25-20(21-17)23(11-10-22(3)4)19(24)16-8-6-5-7-9-16/h5-9,12-13H,10-11H2,1-4H3/p+1