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

Systemtic Name: 2-[(4-chloranyl-1,3-benzothiazol-2-yl)-(phenylcarbonyl)amino]ethyl-diethyl-azanium Openeye Name: 2-[benzoyl-(4-chloro-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium CAS Name: 2-[benzoyl-(4-chloro-1,3-benzothiazol-2-yl)amino]ethyl-diethylammonium IUPAC Name: 2-[benzoyl-(4-chloro-1,3-benzothiazol-2-yl)amino]ethyl-diethylazanium Traditional Name: 2-[benzoyl-(4-chloro-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium Formula: C20H23ClN3OS+ MolecularWeight: 388.93412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3OS/c1-3-23(4-2)13-14-24(19(25)15-9-6-5-7-10-15)20-22-18-16(21)11-8-12-17(18)26-20/h5-12H,3-4,13-14H2,1-2H3/p+1